CAS No.5810-42-4,Tetrapropyl ammonium chloride Suppliers

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Basic Information

Molecular Structure:
CAS No.:	5810-42-4
Name:	Tetrapropyl ammonium chloride

Formula:	C₁₂H₂₈ClN
Molecular Weight:	221.814
Synonyms:	Tetra-n-propylammonium chloride;1-Propanaminium,N,N,N-tripropyl-, chloride (9CI);Ammonium, tetrapropyl-, chloride (8CI);Tetrapropylammonium chloride (6CI,7CI);N,N,N-Tripropyl-1-propanaminiumchloride;1-Propanaminium, N,N,N-tripropyl-, chloride;1-propanaminium, N,N,N-tripropyl-, chloride (1:1);n,n,n-tripropylpropan-1-aminium chloride;
EINECS:	227-375-5
Density:	1.41g/cm³
Melting Point:	240-242 °C(lit.)
Boiling Point:	358.03°C (rough estimate)
Solubility:	Soluble in water, acetone
Appearance:	solid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36-37/39
PSA:	0.00000
LogP:	0.44720

Synthetic route

: 887280-10-6
3,5-bis(bis[(N'-tert-butylureayl)-N-ethyl]aminomethyl)-1H-pyraze

: 5810-42-4
Tetrapropylammonium chloride

: 7732-18-5
water

: 7646-79-9
cobalt(II) chloride

: tetrapropylammonium μ-hydroxo-μ-(3,5-bis(bis[(N'-tert-butylureaylato)-N-ethyl]aminatomethyl)-1H-pyrazolato)dicobaltate(II)

Conditions

Conditions	Yield
With KH In N,N-dimethyl acetamide byproducts: KCl; (Ar); a soln. of ligand treated with KH, CoCl2 added, stirred for 30 min, H2O added, stirred for 30 min, N(C3H7)4Cl added, stirred for 1 h; evapd. (vac., at room temp.), washed (Et2O), dried (vac.), dissolved in CH2Cl2, filtered, evapd. (vac.); elem. anal.;	99%

...Expand

: 60-35-5
acetamide

: 887280-12-8
3,5-bis(bis[(N'-isopropylureayl)-N-ethyl]aminomethyl)-1H-pyraze

: 5810-42-4
Tetrapropylammonium chloride

: 7646-79-9
cobalt(II) chloride

: tetrapropylammonium μ-1,3-acetamido-μ-(3,5-bis(bis[(N'-isopropylureaylato)-N-ethyl]aminatomethyl)-1H-pyrazolato)dicobaltate(II)

Conditions

Conditions	Yield
With KH In N,N-dimethyl acetamide byproducts: KCl; (Ar); a soln. of C3H2N2(CH2N(C2H4NHC(O)NHCH(CH3)2)2)2 treated with KH, CoCl2 added, stirred, acetamide added, stirred, N(C3H7)4Cl added, stirred; evapd. (vac., at room temp.), washed (Et2O), dried (vac.), dissolved in CH2Cl2, filtered, evapd. (vac.); elem. anal.;	99%

...Expand

: 60-35-5
acetamide

: 887280-10-6
3,5-bis(bis[(N'-tert-butylureayl)-N-ethyl]aminomethyl)-1H-pyraze

: 5810-42-4
Tetrapropylammonium chloride

: 7646-79-9
cobalt(II) chloride

: tetrapropylammonium μ-1,3-acetamido-μ-(3,5-bis(bis[(N'-tert-butylureaylato)-N-ethyl]aminatomethyl)-1H-pyrazolato)dicobaltate(II)

Conditions

Conditions	Yield
With KH In N,N-dimethyl acetamide byproducts: KCl; (Ar); a soln. of C3H2N2(CH2N(C2H4NHC(O)NHC(CH3)3)2)2 treated with KH, CoCl2 added, stirred for 30 min, acetamide added, stirred for 30 min, N(C3H7)4Cl added, stirred for 1 h; evapd. (vac., at room temp.), washed (Et2O), dried (vac.), dissolved in CH2Cl2, filtered, evapd. (vac.);	99%

...Expand

: 127-19-5
N,N-dimethyl acetamide

: 887280-12-8
3,5-bis(bis[(N'-isopropylureayl)-N-ethyl]aminomethyl)-1H-pyraze

: 5810-42-4
Tetrapropylammonium chloride

: 71-48-7, 917-69-1, 5931-89-5, 55881-15-7, 68931-68-0, 68931-69-1, 93029-27-7
cobalt(II) acetate

: tetrapropylammonium μ-1,3-acetato-μ-(3,5-bis(bis[(N'-isopropylureaylato)-N-ethyl]aminatomethyl)-1H-pyrazolato)dicobaltate(II) N,N-dimethylacetamide adduct (1/1)

Conditions

Conditions	Yield
With KH In N,N-dimethyl acetamide byproducts: KCl, KCH3COO; (Ar); a soln. of C3H2N2(CH2N(C2H4NHC(O)NHC(CH3)3)2)2 treated with KH, Cosalt added, stirred, N(C3H7)4Cl added, stirred; evapd. (vac., at room temp.), washed (Et2O), dried (vac.), dissolved in CH2Cl2, filtered, evapd. (vac.); elem. anal.;	99%

...Expand

: 127-19-5
N,N-dimethyl acetamide

: 887280-10-6
3,5-bis(bis[(N'-tert-butylureayl)-N-ethyl]aminomethyl)-1H-pyraze

: 5810-42-4
Tetrapropylammonium chloride

: 71-48-7, 917-69-1, 5931-89-5, 55881-15-7, 68931-68-0, 68931-69-1, 93029-27-7
cobalt(II) acetate

: tetrapropylammonium μ-1,3-acetato-μ-(3,5-bis(bis[(N'-tert-butylureaylato)-N-ethyl]aminatomethyl)-1H-pyrazolato)dicobaltate(II) N,N-dimethylacetamide adduct (1/1)

Conditions

Conditions	Yield
With KH In N,N-dimethyl acetamide byproducts: KCl, KCH3COO; (Ar); a soln. of C3H2N2(CH2N(C2H4NHC(O)NHC(CH3)3)2)2 treated with KH, Cosalt added, stirred for 30 min, N(C3H7)4Cl added, stirred for 1 h; evapd. (vac., at room temp.), washed (Et2O), dried (vac.), dissolved in CH2Cl2, filtered, evapd. (vac.); elem. anal.;	99%

...Expand

: 75-09-2
dichloromethane

: 1000006-56-3
3-(bis[(N'-tert-butylureaylato)-N-ethyl]aminatomethyl)-5-tert-butyl-1H-pyrazole

: 5810-42-4
Tetrapropylammonium chloride

: 7732-18-5
water

: 71-48-7, 917-69-1, 5931-89-5, 55881-15-7, 68931-68-0, 68931-69-1, 93029-27-7
cobalt(II) acetate

: tetrapropylammonium 3-(bis[(N'-tert-butylureaylato)-N-ethyl]aminatomethyl)-5-tert-butyl-1H-pyrazolato(hydroxo)cobaltate(II) dichloromethane adduct (1/0.8)

Conditions

Conditions	Yield
With KH In N,N-dimethyl acetamide byproducts: KCl; (Ar); a soln. of ligand treated with KH, Co salt added, stirred, filtered, H2O added, stirred for 30 min, N(C3H7)4Cl added, stirred for 1 h; dissolved in CH2Cl2, filtered, evapd. (vac.), washed (Et2O/pentane), dried (vac.); elem. anal.;	95%

...Expand

: 1,10-bis(phenyliodonium)-closo-decaborate

: 5810-42-4
Tetrapropylammonium chloride

: B10H8I2(2-)*2C12H28N(1+)

Conditions

Conditions	Yield
Stage #1: 1,10-bis(phenyliodonium)-closo-decaborate With n-butyllithium In tetrahydrofuran; hexane at -10 - -5℃; for 1h; Inert atmosphere; Stage #2: Tetrapropylammonium chloride Inert atmosphere;	95%

: 75-09-2
dichloromethane

: 887280-12-8
3,5-bis(bis[(N'-isopropylureayl)-N-ethyl]aminomethyl)-1H-pyraze

: 5810-42-4
Tetrapropylammonium chloride

: 7732-18-5
water

: 7646-79-9
cobalt(II) chloride

: tetrapropylammonium μ-hydroxo-μ-(3,5-bis(bis[(N'-isopropylureaylato)-N-ethyl]aminatomethyl)-1H-pyrazolato)dicobaltate(II) dichloromethane adduct (10/1)

Conditions

Conditions	Yield
With KH In N,N-dimethyl acetamide byproducts: KCl; (Ar); a soln. of ligand treated with KH, CoCl2 added, stirred, H2O added, stirred, N(C3H7)4Cl added, stirred; evapd. (vac., at room temp.), washed (Et2O), dried (vac.), dissolved in CH2Cl2, filtered, evapd. (vac.); elem. anal.;	94%

...Expand

: potassium hexacyanocobaltate(III)

: 1066-45-1
trimethyltin(IV)chloride

: 5810-42-4
Tetrapropylammonium chloride

: (C3H7)4N(1+)*2Sn(CH3)3(1+)*Co(CN)6(3-)*2H2O=N(C3H7)4(Sn(CH3)3)2Co(CN)6*2H2O

Conditions

Conditions	Yield
In water K3Co(CN)6 in H2O was added under stirring to soln. of ligand and Sn-complex in H2O, 15 min; filtered, washed with H2O, dried at room temp. for ca. 10 h; elem. anal.;	90%

...Expand

: [(Me3Sn)3Fe(CN)6]n

: 5810-42-4
Tetrapropylammonium chloride

: (C3H7)4N(1+)*2Sn(CH3)3(1+)*Fe(CN)6(3-)*2H2O=N(C3H7)4(Sn(CH3)3)2Fe(CN)6*2H2O

Conditions

Conditions	Yield
In water SnFe-complex was reacted with ligand in H2O, stirred for 12 h; filtered, washed with H2O, dried; elem. anal.;	90%

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Specification

The Tetrapropyl ammonium chloride, with the CAS registry number 5810-42-4 and EINECS registry number 227-375-5, has the systematic name of N,N,N-tripropylpropan-1-aminium chloride. And the molecular formula of this chemical is C₁₂H₂₈ClN. It is a kind of hygroscopic solid, and belongs to the following product categories: Quarternary ammonium salts; Ammonium Chlorides (Quaternary); Quaternary Ammonium Compounds; Ammonium Salts; Greener Alternatives: Catalysis; Phase Transfer Catalysts.

The physical properties of Tetrapropyl ammonium chloride are as following: (1)ACD/LogP: -2.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.64; (4)ACD/LogD (pH 7.4): -2.64; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 0 Å².

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].C(C[N+](CCC)(CCC)CCC)C
(2)InChI: InChI=1/C12H28N.ClH/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H/q+1;/p-1
(3)InChIKey: FBEVECUEMUUFKM-REWHXWOFAR