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CAS No.: | 25834-99-5 |
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Name: | 4,4-DIMETHYLCYCLOHEXYLAMINE HYDROCHLORIDE |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C8H18ClN |
Molecular Weight: | 163.691 |
Synonyms: | Cyclohexanamine,4,4-dimethyl-, hydrochloride (9CI);Cyclohexylamine, 4,4-dimethyl-,hydrochloride (8CI);(4,4-Dimethylcyclohexyl)amine hydrochloride;4,4-Dimethylcyclohexanamine hydrochloride; |
Density: | 0.834g/cm3 |
Melting Point: | 280 °C |
Boiling Point: | 162 °C at 760 mmHg |
Flash Point: | 42.2 °C |
PSA: | 26.02000 |
LogP: | 3.41620 |
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The Cyclohexanamine,4,4-dimethyl-, hydrochloride (1:1) is an organic compound with the formula C8H18ClN. The systematic name of this chemical is N,N-dimethylcyclohexanamine hydrochloride (1:1). With the CAS registry number 25834-99-5, it is also named as cyclohexyldimethylammonium chloride.
Physical properties about Cyclohexanamine,4,4-dimethyl-, hydrochloride (1:1) are: (1)ACD/LogP: 2.12; (2)ACD/LogD (pH 5.5): -0.97; (3)ACD/LogD (pH 7.4): -0.77; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 3.24 Å2; (11)Flash Point: 42.2 °C; (12)Enthalpy of Vaporization: 39.86 kJ/mol; (13)Boiling Point: 162 °C at 760 mmHg; (14)Vapour Pressure: 2.21 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.N(C)(C)C1CCCCC1
(2)InChI: InChI=1/C8H17N.ClH/c1-9(2)8-6-4-3-5-7-8;/h8H,3-7H2,1-2H3;1H
(3)InChIKey: KBXRGBYSPXRSOZ-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C8H17N.ClH/c1-9(2)8-6-4-3-5-7-8;/h8H,3-7H2,1-2H3;1H
(5)Std. InChIKey: KBXRGBYSPXRSOZ-UHFFFAOYSA-N