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56-37-1

Basic Information
CAS No.: 56-37-1
Name: Benzenemethanaminium,N,N,N-triethyl-, chloride (1:1)
Molecular Structure:
Molecular Structure of 56-37-1 (Benzenemethanaminium,N,N,N-triethyl-, chloride (1:1))
Formula: C13H22ClN
Molecular Weight: 227.78
Synonyms: Ammonium,benzyltriethyl-, chloride (8CI);Benzenemethanaminium, N,N,N-triethyl-,chloride (9CI);Benzyltriethylammonium chloride (6CI);BAC-TE;N,N,N-Triethyl-N-benzylammonium chloride;TEBA;TEBAC;Triethylbenzylammoniumchloride;Benzenemethanaminium, N,N,N-triethyl-, chloride;
EINECS: 200-270-1
Density: 1.08 g/mL at 25 °C
Melting Point: 239 °C (dec.)(lit.)
Boiling Point: 366.11°C (rough estimate)
Flash Point: > 100 °C
Solubility: 700 g/L (20 °C) in water
Appearance: white to light yellow crystallize powder
Hazard Symbols: HarmfulXn, IrritantXi
Risk Codes: 36/37/38-20/21/22
Safety: 26-36-37/39
Transport Information: UN 2811 6.1/PG 3
PSA: 0.00000
LogP: 0.06710
Synthetic route
100-44-7

benzyl chloride

121-44-8

triethylamine

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

Conditions
ConditionsYield
at 20℃;100%
In acetonitrile for 1h; Reflux;95%
75%
554-68-7

triethylamine hydrochloride

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

Conditions
ConditionsYield
With 1-ethyl-3-methylimidazolium bromide at 169.84℃; for 8h;99%
100-44-7

benzyl chloride

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

Conditions
ConditionsYield
In polydimethylsiloxane76.3%
100-44-7

benzyl chloride

121-44-8

triethylamine

A

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

B

103-29-7

1,1'-(1,2-ethanediyl)bisbenzene

Conditions
ConditionsYield
2 In acetonitrile for 24h; Product distribution; Irradiation; 1-bromopentane as other substrate; various photocatalysts;A 70%
B 22%
138554-42-4

triethylbenzylammonium 2,4-dinitrophenolate

A

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

B

1,2,3,4,6-Pentachloro-5-(2,4-dinitro-phenoxy)-[1,3,5,2,4,6]triazatriphosphinane

Conditions
ConditionsYield
With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine In chloroform at 24.9℃; Rate constant; var. solvents;
138554-42-4

triethylbenzylammonium 2,4-dinitrophenolate

A

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

B

1,2,3,4,5,6,8-Heptachloro-7-(2,4-dinitro-phenoxy)-[1,3,5,7,2,4,6,8]tetrazatetraphosphocane

Conditions
ConditionsYield
With octachlorocyclotetraphosphazene In chloroform at 24.9℃; Rate constant; var. solvents;
138554-42-4

triethylbenzylammonium 2,4-dinitrophenolate

A

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

B

157033-41-5

2,2,4,4,6-Pentachloro-6-(2,4-dinitro-phenoxy)-2λ5,4λ5,6λ5-[1,3,5,2,4,6]triazatriphosphinine

Conditions
ConditionsYield
With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine; 4-nitro-phenol; buffer pH 9.18 In chlorobenzene at 24.9℃; Rate constant; Equilibrium constant; Mechanism; other proton donors, var. pH;
138554-40-2

4-Nitro-phenolatebenzyl-triethyl-ammonium;

A

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

B

1,2,3,4,6-Pentachloro-5-(4-nitro-phenoxy)-[1,3,5,2,4,6]triazatriphosphinane

Conditions
ConditionsYield
With 2,2,4,4,6,6-hexachloro-1,3,5-triaza-2,4,6-triphosphorine In chloroform at 24.9℃; Rate constant; Mechanism; var. solvents, other phenols and cyclophosphazenes;

triethylbenzylammonium diiodochloride

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

Conditions
ConditionsYield
In chloroform Equilibrium constant;
1133239-24-3

dichloro(bis(2-isopropylamino-4-methoxyphenyl)amine(-3H))tantalum(V)

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

C20H26Cl3N3O2Ta(1-)*C13H22N(1+)

Conditions
ConditionsYield
In tetrahydrofuran for 12h; Inert atmosphere;99%

C18H20Cl2F2N3Ta*0.5C7H8

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

C18H20Cl3F2N3Ta(1-)*C13H22N(1+)

Conditions
ConditionsYield
In tetrahydrofuran for 12h; Inert atmosphere;99%

C18H22Cl2N3Ta

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

C18H22Cl3N3Ta(1-)*C13H22N(1+)

Conditions
ConditionsYield
In tetrahydrofuran for 12h; Inert atmosphere;99%

C20H26Cl2N3Ta

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

C20H26Cl3N3Ta(1-)*C13H22N(1+)

Conditions
ConditionsYield
In tetrahydrofuran for 12h; Inert atmosphere;99%

C26H38Cl2N3Ta

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

C26H38Cl3N3Ta(1-)*C13H22N(1+)

Conditions
ConditionsYield
In tetrahydrofuran for 12h; Inert atmosphere;99%
2424-92-2

octadecane-1,18-dicarboxylic acid

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

106-89-8

epichlorohydrin

A

octadecane-1,18-dicarboxylic acid glycidyl ester

B

octadecane-1,18-dicarboxylic acid diglycidyl ester

Conditions
ConditionsYield
With sodium hydroxideA 98.4%
B n/a
91543-32-7

tris(pentafluoroethyl)difluorophosphorane

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

1042169-47-0

benzyltriethylammonium tris(pentafluoroethyl)difluorochlorophosphate

Conditions
ConditionsYield
In acetonitrile at 20℃; for 1h;98.2%
56-37-1

N-benzyl-N,N,N-triethylammonium chloride

benzyltriethylammonium borohydride

Conditions
ConditionsYield
With sodium tetrahydroborate In methanol at 20℃; for 1.5h;98%
7697-46-3

phenyl(1H-pyrrol-2-yl)methanone

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

(1-benzyl-1H-pyrrol-2-yl)(phenyl)methanone

Conditions
ConditionsYield
With sodium hydroxide In water; toluene for 2h; Reflux; chemoselective reaction;98%

acetylacetonatodicarbonylrhodium(l)

603-32-7

triphenyl-arsane

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

75802-04-9

3(C6H5CH2N(C2H5)3)(1+)*(Rh10As(CO)22)(3-)*OC4H8=(C6H5CH2N(C2H5)3)3(Rh10As(CO)22)*OC4H8

Conditions
ConditionsYield
With cesium benzoate trihydrate; cesium borohydride; carbon monoxide In isopropyl alcohol; acetone High Pressure; to Rh(CO)2acac, PhCOOCs*3H2O, AsPh3 and CsBH4 mixed in tetraglyme and soln. stirred under 6000 psi CO-H2 at 150°C for 2 h, mixt. filtered, toluene added, oil dissolved in acetone, (PhCH2NEt3)Cl in 2-propanoladded; ppt. filtered, washed with 2-propanol and vac.-dried; elem. anal.;97.8%
56-37-1

N-benzyl-N,N,N-triethylammonium chloride

benzyltriethylammonium chloride aluminium chloride

Conditions
ConditionsYield
With aluminum (III) chloride In dichloromethane at 5 - 20℃; for 12.5h; Inert atmosphere;97%

germanium(II) chloride dioxane

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

208348-62-3

benzyltriethylammonium trichlorogermanate(II)

Conditions
ConditionsYield
In tetralin byproducts: dioxane; (N2); stirring (70°C, 15 min); removal of volatiles (vac., room temp., 12 h), filtration at -20°C, washing (pentane), drying (vac.); elem. anal.;96.7%
75-09-2

dichloromethane

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

125627-85-2

7-O-sec-butyl-6-hydroxy-2,2-dimethyl-4-chromanone

125627-93-2

7-O-sec-butyl-6-methoxy-2,2-dimethyl-4-chromanone

Conditions
ConditionsYield
In sodium hydroxide; water96%
56-37-1

N-benzyl-N,N,N-triethylammonium chloride

13470-13-8

tungsten(IV) chloride

A

215669-98-0

C6H5CH2N(C2H5)3(1+)*WCl6(1-)=C6H5CH2N(C2H5)3WCl6

B

2C6H5CH2N(C2H5)3(1+)*W2Cl9(2-)=[C6H5CH2N(C2H5)3]2W2Cl9

Conditions
ConditionsYield
In dichloromethane react. for several days at 25°C, filtration, washing (CH2Cl2), drying (vac.), cooling of supenatant and crystn. of WCl6-salt; elem. anal.;A 37%
B 96%
1159937-12-8

3,5-bis(2-methoxyphenyl)-1H-pyrazole

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

584-08-7

potassium carbonate

potassium hydroxide

1227401-55-9

bis(3,5-bis(2-methoxyphenyl)-1H-pyrazol-1-yl)methane

Conditions
ConditionsYield
In dichloromethane for 12h; Reflux;96%
100506-76-1

[(cyclopentadienyl)Ru(η6-naphthalene)]BF4

119072-55-8, 7188-38-7

tert-butylisonitrile

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

C15H23ClN2Ru

Conditions
ConditionsYield
In dichloromethane for 12h; Inert atmosphere;96%
56-37-1

N-benzyl-N,N,N-triethylammonium chloride

62635-69-2

sodium di(1,1,3-trihydrotetrafluoropropyl) sulfosuccinate

80563-71-9

1,2-Bis-(2,2,3,3-tetrafluoro-propoxycarbonyl)-ethanesulfonatebenzyl-triethyl-ammonium;

Conditions
ConditionsYield
In ethanol at 75 - 80℃;95.1%
In ethanol at 78℃; for 2h;
56-37-1

N-benzyl-N,N,N-triethylammonium chloride

141-52-6

sodium ethanolate

95903-96-1

triethylbenzylammonium ethanolate

Conditions
ConditionsYield
at 5℃; for 12h;95%
In ethanol Ambient temperature;
56-37-1

N-benzyl-N,N,N-triethylammonium chloride

103-82-2

phenylacetic acid

Conditions
ConditionsYield
With sodium hydroxide; Co(CO)8; methyl iodide In benzene Mechanism; Ambient temperature; other quaternaryammonium salts;95%
56-37-1

N-benzyl-N,N,N-triethylammonium chloride

5400-94-2

triethylbenzylammonium iodide

Conditions
ConditionsYield
With trimethylsilyl iodide In acetonitrile for 0.5h; Heating;95%
98821-58-0

closo-3-I-2,4-C2B5H6

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

28347-93-5

3-Cl-closo-2,4-C2B5H6

Conditions
ConditionsYield
With trimethylamine In dichloromethane-d2 allowing to stand at room temp., 43d; monitoring by 11B NMR;95%
In dichloromethane allowing to stand at room temp., 9d; monitoring by 11B NMR;78%

(2-methylallyl)palladium-chloride dimer

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

76096-87-2

(C2H5)3N(CH2C6H5)(1+)*PdCl2(C3H4CH3)(1-)=(C2H5)3N(CH2C6H5)[PdCl2(C3H4CH3)]

Conditions
ConditionsYield
In dichloromethane soln. of Pd complex treated with anhydrous NEt3(CH2Ph)Cl; concd., added to excess Et2O, crystd. on stirring, recrystd. from CH2Cl2-Et2O; elem. anal.;95%
75-09-2

dichloromethane

215669-96-8

(BnEt3N)[W2(μ-Cl)3Cl6]

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

2C6H5CH2N(C2H5)3(1+)*W2Cl10(2-)*CH2Cl2=[C6H5CH2N(C2H5)3]2W2Cl10*CH2Cl2

Conditions
ConditionsYield
In dichloromethane at -30°C for 1 day, filtration, washing, drying; elem. anal.;95%

[(C4Et4)Rh(p-xylene)]+PF6

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

C12H20ClRh

Conditions
ConditionsYield
In dichloromethane for 24h; Inert atmosphere;95%
17771-33-4

7-hydroxy-2,2-dimethyl-chroman-4-one

75-09-2

dichloromethane

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

20321-73-7

7-methoxy-2,2-dimethyl-4-chromanone

Conditions
ConditionsYield
In sodium hydroxide; water94.6%
215669-98-0

C6H5CH2N(C2H5)3(1+)*WCl6(1-)=C6H5CH2N(C2H5)3WCl6

2C6H5CH2N(C2H5)3(1+)*W2Cl9(2-)=[C6H5CH2N(C2H5)3]2W2Cl9

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

2C6H5CH2N(C2H5)3(1+)*WCl6(2-)=[C6H5CH2N(C2H5)3]2WCl6

Conditions
ConditionsYield
In not given94%
7719-09-7

thionyl chloride

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

13499-05-3

hafnium tetrachloride

7705-07-9

titanium(III) chloride

di[triethylbenzylammonium] decachloridohafnatetitanate

Conditions
ConditionsYield
In neat (no solvent) (Ar), HfCl4, TiCl3, (Et3NBz)Cl (1:1:2) treated dropwise under stirring with SOCl2, refluxed for 1 h, cooled to room temp., stirred for 2 h; concd.(vac.), pptd.(pentane), filtered, washed (pentane), dried (vac.) for 2 h, elem. anal.;94%
7719-09-7

thionyl chloride

56-37-1

N-benzyl-N,N,N-triethylammonium chloride

13499-05-3

hafnium tetrachloride

di[triethylbenzylammonium] decachloridodihafnate

Conditions
ConditionsYield
In neat (no solvent) (Ar), HfCl4 and (Et3NBz)Cl(1:1) treated dropwise under stirring with SOCl2, heated to 65°C for 1 h, cooled to room temp., stirred for 1 h; pptd.(pentane), filtered, washed (pentane), dried (vac.) overnight, elem. anal.;94%
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    Benzyl Triethyl Ammonium Chloride CAS No.: 56-37-1 Molecular Formula: C13H22NCl Molecular Weight:227.77 Structural formula: A.Physical & Chemical Properties 1.Melting point:185℃ 2.Solubility:could be dissolved by water, grain alcohol

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  • Benzyl Triethyl Ammonium Chloride  CAS: 56-37-1

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    Benzyl Triethyl Ammonium Chloride CAS: 56-37-1

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    Chemical Name: Benzyltriethylammonium chloride CAS No.: 56-37-1 Molecular Fomula:C13H22ClN Chemical Structure: Molecular weight: 227.77 Appearance: white powder Assay: 99%min Appearance:White powder Storage:Store in cool and dry place,

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    56-37-1

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    Benzyltriethylammonium chloride Basic information Product Name: Benzyltriethylammonium chloride Synonyms: BENZYLTRIETYLAMMONIUM CHLORIDE;BENZYL TRIMETHYL AMMONIUM CHLORIDE (BTMAC50) SURF

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Specification

The IUPAC name of Benzyltriethylammonium chloride is benzyl(triethyl)azanium chloride. With the CAS registry number 56-37-1, it is also named as Benzenemethanaminium, N,N,N-triethyl-, chloride. The product's categories are Pharmaceutical Intermediates; Ammonium Chlorides (Quaternary); Quaternary Ammonium Compounds; Ammonium Salts; Greener Alternatives: Catalysis; Phase Transfer Catalysts, and the other registry numbers are 130517-24-7; 64333-37-5; 80904-15-0. Besides, it is white to light yellow crystallize powder, which should be stored in sealed and dry place. It is stable, but incompatible with strong oxidizing agents. In addition, its molecular formula is C13H22ClN and molecular weight is 227.78.

The other characteristics of this product can be summarized as: (1)ACD/LogP: -2.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.08; (4)ACD/LogD (pH 7.4): -2.08; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.76; (8)ACD/KOC (pH 7.4): 1.76; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Density: 1.08 g/mL at 25 °C; (13)Flash Point: > 100 °C; (14)Melting point: 185 °C ; (15)Water Solubility: 700 g/L (20 °C); (16)EINECS: 200-270-1.

Preparation of Benzyltriethylammonium chloride: this chemical can be prepared by the reaction of Benzyl chloride with Triethylamine. This reaction needs Acetone. The yield is 68.9%.

Uses of Benzyltriethylammonium chloride: this chemical is phase transfer catalyst used in the alkylation reation. It is also used as fungicide and cationic surfactant. Additionally, it can react with 1H-Pyridine-2-thione to get 2-Benzylsulfanyl-pyridine.



This reaction needs 50percent aq. NaOH and Benzene at temperature of 80 °C for 6 hours. The yield is 70 %.

When you are using this chemical, please be cautious about it as the following: it is irritating to eyes, respiratory system and skin. It is also harmful by inhalation, in contact with skin and if swallowed. In case of contact with eyes, please rinse immediately with plenty of water and seek medical advice. And you should wear suitable protective clothing, gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
(1)SMILES: [Cl-].c1ccccc1C[N+](CC)(CC)CC
(2)InChI: InChI=1/C13H22N.ClH/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;/h7-11H,4-6,12H2,1-3H3;1H/q+1;/p-1
(3)InChIKey: HTZCNXWZYVXIMZ-REWHXWOFAI

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01867,
rat LD50 oral 2219mg/kg (2219mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 15(Suppl