CAS No.53309-35-6,1-Chloro-N,N-dimethyl-2-propylamine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	53309-35-6
Name:	1-Chloro-N,N-dimethyl-2-propylamine
Article Data:	3

Formula:	C₅H₁₂ClN
Molecular Weight:	121.61
Synonyms:	2-propanamine, 1-chloro-N,N-dimethyl-;
Density:	0.934 g/cm³
Boiling Point:	81.1 °C at 760 mmHg
Flash Point:	2.9 °C
PSA:	3.24000
LogP:	1.17530

Synthetic route

: 2-(Z)-phenylmethylene-cycloheptane-1-one-(E)-oxime

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: 87-69-4
tartaric acid

: 92884-27-0
2-[(E)-phenylmethylene]-1-[(E)-(2'-dimethylamino-2'-methyl-1-ethoxyimino)]-cycloheptane

Conditions

Conditions	Yield
In water; toluene	68.2%

...Expand

: 62266-82-4
6-bromo-1,3-benzothiazol-2(3H)-one

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: 6-bromo-3-(2-dimethylaminopropyl)benzo[d]thiazol-2(3H)one

Conditions

Conditions	Yield
With caesium carbonate In N,N-dimethyl-formamide at 80℃;	38%

: 120-72-9
indole

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: 17380-14-2
1-(1H-indol-1-yl)-N,N-dimethylpropan-2-amine

Conditions

Conditions	Yield
With diethyl ether; phenyllithium

: 13948-37-3
2-benzylthiazole

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: dimethyl-(1-methyl-3-phenyl-3-thiazol-2-yl-propyl)-amine

Conditions

Conditions	Yield
With sodium

: 5381-25-9
benzo[b]thiophene-3-carboxylic acid

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: 107521-96-0
benzo[b]thiophene-2-carboxylic acid-(2-dimethylamino-propyl ester)

Conditions

Conditions	Yield
With isopropyl alcohol

: 261-31-4
thioxanthene

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: dimethyl-(1-methyl-2-thioxanthen-9-yl-ethyl)-amine

Conditions

Conditions	Yield
With phenyl sodium; benzene

: 32570-18-6
1-(2-hydroxyphenyl)-2,5-dimethylpyrrole

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: 1-[2-(2-dimethylamino-propoxy)-phenyl]-2,5-dimethyl-pyrrole

Conditions

Conditions	Yield
With sodium hydroxide

: 17617-05-9
pyridin-3-yl-methanethiol

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: 102206-62-2
3-[(2-dimethylamino-propylmercapto)-methyl]-pyridine

Conditions

Conditions	Yield
With ethanol; sodium ethanolate

: 451-40-1
phenyl benzyl ketone

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

: 857483-91-1
4-dimethylamino-1,2-diphenyl-pentan-1-one

Conditions

Conditions	Yield
With sodium amide; benzene

: 56-23-5
tetrachloromethane

: 86-29-3
Diphenylacetonitrile

: 865-47-4
potassium tert-butylate

: 53309-35-6
(2-chloro-1-methyl-ethyl)-dimethyl-amine

A: 125-79-1
(R,S)-2,2-diphenyl-4-dimethylaminopentanenitrile

B: 6293-01-2
2,2-diphenyl-3-methyl-4-(dimethylamino)-butyronitrile

...Expand

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Specification

The 1-Chloro-N,N-dimethyl-2-propylamine, with the CAS registry number 53309-35-6, is also known as 2-Propanamine, 1-chloro-N,N-dimethyl-. This chemical's molecular formula is C₅H₁₂ClN and molecular weight is 121.60848. What's more, its systematic name is 1-Chloro-N,N-dimethylpropan-2-amine.

Physical properties about 1-Chloro-N,N-dimethyl-2-propylamine: (1)ACD/LogP: 0.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.9; (4)ACD/LogD (pH 7.4): -0.28; (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): 5.22; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.432; (14)Molar Refractivity: 33.74 cm³; (15)Molar Volume: 130 cm³; (16)Surface Tension: 25.5 dyne/cm ; (17)Density: 0.934 g/cm³; (18)Flash Point: 2.9 °C; (19)Enthalpy of Vaporization: 32.18 kJ/mol; (20)Boiling Point: 81.1 °C at 760 mmHg; (21)Vapour Pressure: 83 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: ClCC(N(C)C)C
(2) InChI: InChI=1/C5H12ClN/c1-5(4-6)7(2)3/h5H,4H2,1-3H3
(3) InChIKey: ZMLUHYJUTIZTOJ-UHFFFAOYAP