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1941-30-6

Basic Information
CAS No.: 1941-30-6
Name: Tetrapropylammonium bromide
Article Data: 8
Molecular Structure:
Molecular Structure of 1941-30-6 (Tetrapropylammonium bromide)
Formula: C12H28NBr
Molecular Weight: 266.265
Synonyms: 1-Propanaminium,N,N,N-tripropyl-, bromide (9CI);Ammonium, tetrapropyl-, bromide (8CI);Tetrapropylammonium bromide (6CI);TPABr;Tetra-n-propylammonium bromide;
EINECS: 217-727-6
Density: 1.1949 (rough estimate)
Melting Point: 266-272 °C
Solubility: water: 100 g/L in water
Appearance: white crystals or crystalline powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-37/39
PSA: 0.00000
LogP: 0.44720
Synthetic route
102-69-2

tri-n-propylamine

106-94-5

propyl bromide

1941-30-6

tetra-n-propylammonium bromide

Conditions
ConditionsYield
In ethanol
In butanone at 80℃; for 96h;
In acetonitrile for 24h; Reflux;
In N,N-dimethyl-formamide at 110℃; for 15h; Inert atmosphere;
106-94-5

propyl bromide

1941-30-6

tetra-n-propylammonium bromide

Conditions
ConditionsYield
With tri-n-propylamine In N-methyl-acetamide
With tri-n-propylamine
With tri-n-propylamine In nitromethane
1392488-20-8

C6H5O(1-)*C6H6O*C12H28N(1+)

100-39-0

benzyl bromide

A

946-80-5

(benzyloxy)benzene

B

1941-30-6

tetra-n-propylammonium bromide

C

108-95-2

phenol

Conditions
ConditionsYield
In acetonitrile at 20℃;

Br(1-)*C12H28N(1+)*C4H10O2

A

75-91-2

tert.-butylhydroperoxide

B

1941-30-6

tetra-n-propylammonium bromide

Conditions
ConditionsYield
In [D3]acetonitrile at 24.84℃; Equilibrium constant;

manganese(II) chloride hexahydrate

chromium(III) chloride * 3H2O

1941-30-6

tetra-n-propylammonium bromide

17148-97-9, 20267-56-5

potassium 1,2-dithiooxalate

tetra-n-propylammonium MnCr(dithiooxalato)3

Conditions
ConditionsYield
In water K-salt in water was added to CrCl3*6H2O in water, the soln. was heated for 30 min at 60°C, chloride was added, the soln. was heated at 80°C for 20 min, ammonium salt was added, the soln. was maintained at 80°C, cooled; filtered, washed with water, methanol, diethyl ether; elem. anal.;100%

nickel(II) dichloride hydrate

chromium(III) chloride * 3H2O

1941-30-6

tetra-n-propylammonium bromide

17148-97-9, 20267-56-5

potassium 1,2-dithiooxalate

tetra-n-propylammonium [NiCr(dithiooxalato)3]

Conditions
ConditionsYield
In water K-salt in water was added to CrCl3*6H2O in water, the soln. was heated for 30 min at 60°C, chloride was added, the soln. was heated at 80°C for 20 min, ammonium salt was added, the soln. was maintained at 80°C, cooled; filtered, washed with water, methanol, diethyl ether; elem. anal.;100%

cobalt(II) chloride hydrate

chromium(III) chloride * 3H2O

1941-30-6

tetra-n-propylammonium bromide

17148-97-9, 20267-56-5

potassium 1,2-dithiooxalate

tetra-n-propylammonium [CoCr(dithiooxalato)3]

Conditions
ConditionsYield
In water K-salt in water was added to CrCl3*6H2O in water, the soln. was heated for 30 min at 60°C, chloride was added, the soln. was heated at 80°C for 20 min, ammonium salt was added, the soln. was maintained at 80°C, cooled; filtered, washed with water, methanol, diethyl ether; elem. anal.;100%

iron(II) chloride hydrate

chromium(III) chloride * 3H2O

1941-30-6

tetra-n-propylammonium bromide

17148-97-9, 20267-56-5

potassium 1,2-dithiooxalate

tetra-n-propylammonium [FeCr(dithiooxalato)3]

Conditions
ConditionsYield
In water K-salt in water was added to CrCl3*6H2O in water, the soln. was heated for 30 min at 60°C, chloride was added, the soln. was heated at 80°C for 20 min, ammonium salt was added, the soln. was maintained at 80°C, cooled; filtered, washed with water, methanol, diethyl ether; elem. anal.;100%
1941-30-6

tetra-n-propylammonium bromide

tetrapropylammonium nonabromide

Conditions
ConditionsYield
With bromine for 0.5h; Schlenk technique; Inert atmosphere;99%

Cs3K[Re6S8(CN)6].2H2O

1941-30-6

tetra-n-propylammonium bromide

6018-89-9

nickel(II) acetate tetrahydrate

2(CH3CH2CH2)4N(1+)*Ni(H2O)5[Re6S8(CN)6](2-)*H2O=((CH3CH2CH2)4N)2Ni(H2O)5[Re6S8(CN)6]*H2O

Conditions
ConditionsYield
In water gradual addn. of aq. soln. of Cs3KRe6S8(CN)6*2H2O to aq. mixt. of n-Pr4NBr and Ni(CH3COO)2*4H2O, stirring for 2 h at ambient temp.; filtration, washing with water, drying in air; elem. anal.;97%
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  • tetrapropylammonium bromide CAS NO.1941-30-6

  • Casno:

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  • Casno:

    1941-30-6

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    1941-30-6

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Chemistry

Molecular Structure of Tetrapropylammonium bromide (CAS NO.1941-30-6):
.
IUPAC Name: tetrapropylazanium bromide
CAS Registry Number: 1941-30-6
EINECS: 217-727-6
Empirical Formula: C12H28BrN
Molecular Weight: 266.2614
ACD/LogP: -2.64
of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): -2.64
ACD/LogD (pH 7.4): -2.64
ACD/BCF (pH 5.5): 1
ACD/BCF (pH 7.4): 1
ACD/KOC (pH 5.5): 1
ACD/KOC (pH 7.4): 1
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 8
Polar Surface Area: 0Å2
Melting point: 266-272 oC
Water solubility: 100 g/L
Sensitive: Hygroscopic
Melting point: 266-272 °C
solubility H2O: 0.1 g/mL
Water Solubility: 100 g/L
Sensitive: Hygroscopic
BRN: 3567846
InChI
InChI=1/C12H28N.BrH/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H/q+1;/p-1
Smiles
[N+](CCC)(CCC)(CCC)CCC.[BrH-]
Product Categories: quarternary ammonium salts; Ammonium Bromides (Quaternary);Quaternary Ammonium Compounds; Ammonium SaltsAnalytical Reagents; Electrochemistry; Supporting Electrolytes for Electrochemistry; Ammonium Salts; Greener Alternatives: Catalysis; Phase Transfer Catalysts; AnionicHPLC; Chromatography/CE Reagents; Ion Pair; Ion Pair Reagents; Ion Pair Reagents - Anionic

Toxicity Data With Reference

1.    

dnd-mam:lym 50 mmol/L

    CBINA8    Chemico-Biological Interactions. 19 (1977),197.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx, NH3, and Br. See also BROMIDES.
Hazard Codes: IrritantXi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing. 
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany: 3
RTECS: BS8390000
F: 3
HS Code: 29239000

Specification

 Tetrapropylammonium bromide , with CAS number of 1941-30-6, can be called 1-Propanaminium, N,N,N-tripropyl-, bromide ; 1-Propanaminium, N,N,N-tripropyl-, bromide (1:1) ; ammonium compounds, quaternary, tetrapropyl-, bromide . It is a white crystals or crystalline powder. Tetrapropylammonium bromide is hygroscopic. Be incompatible with strong oxidizing agents.