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CAS No.: | 53309-35-6 |
---|---|
Name: | 1-Chloro-N,N-dimethyl-2-propylamine |
Article Data: | 3 |
Molecular Structure: | |
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 |
(2-chloro-1-methyl-ethyl)-dimethyl-amine
tartaric acid
2-[(E)-phenylmethylene]-1-[(E)-(2'-dimethylamino-2'-methyl-1-ethoxyimino)]-cycloheptane
Conditions | Yield |
---|---|
In water; toluene | 68.2% |
6-bromo-1,3-benzothiazol-2(3H)-one
(2-chloro-1-methyl-ethyl)-dimethyl-amine
Conditions | Yield |
---|---|
With caesium carbonate In N,N-dimethyl-formamide at 80℃; | 38% |
indole
(2-chloro-1-methyl-ethyl)-dimethyl-amine
1-(1H-indol-1-yl)-N,N-dimethylpropan-2-amine
Conditions | Yield |
---|---|
With diethyl ether; phenyllithium |
2-benzylthiazole
(2-chloro-1-methyl-ethyl)-dimethyl-amine
Conditions | Yield |
---|---|
With sodium |
benzo[b]thiophene-3-carboxylic acid
(2-chloro-1-methyl-ethyl)-dimethyl-amine
benzo[b]thiophene-2-carboxylic acid-(2-dimethylamino-propyl ester)
Conditions | Yield |
---|---|
With isopropyl alcohol |
thioxanthene
(2-chloro-1-methyl-ethyl)-dimethyl-amine
Conditions | Yield |
---|---|
With phenyl sodium; benzene |
1-(2-hydroxyphenyl)-2,5-dimethylpyrrole
(2-chloro-1-methyl-ethyl)-dimethyl-amine
Conditions | Yield |
---|---|
With sodium hydroxide |
pyridin-3-yl-methanethiol
(2-chloro-1-methyl-ethyl)-dimethyl-amine
3-[(2-dimethylamino-propylmercapto)-methyl]-pyridine
Conditions | Yield |
---|---|
With ethanol; sodium ethanolate |
phenyl benzyl ketone
(2-chloro-1-methyl-ethyl)-dimethyl-amine
4-dimethylamino-1,2-diphenyl-pentan-1-one
Conditions | Yield |
---|---|
With sodium amide; benzene |
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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