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| Name |
Benzeneethanamine,4-chloro-β-phenyl-, hydrochloride (1:1) |
EINECS | N/A |
| CAS No. | 21998-50-5 | Density | N/A |
| PSA | 26.02000 | LogP | 4.93290 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C14H15Cl2N | Boiling Point | 379.6 °C at 760 mmHg |
| Molecular Weight | 268.186 | Flash Point | 183.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols |
 Xi
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| Synonyms |
Benzeneethanamine,4-chloro-b-phenyl-, hydrochloride (9CI);Phenethylamine, p-chloro-b-phenyl-, hydrochloride (6CI,8CI);2-(4-Chlorophenyl)-2-phenylethanaminehydrochloride;2-(4-Chlorophenyl)-2-phenylethylamine hydrochloride; |
Benzeneethanamine,4-chloro-β-phenyl-, hydrochloride (1:1) Specification
The Benzeneethanamine,4-chloro-β-phenyl-, hydrochloride (1:1), with CAS registry number 21998-50-5, has the systematic name of 2-(4-chlorophenyl)-2-phenylethanamine hydrochloride. And the chemical formula of this chemical is C14H15Cl2N.
Physical properties of Benzeneethanamine,4-chloro-β-phenyl-, hydrochloride (1:1): (1)ACD/LogP: 3.60; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 26.02 Å2; (7)Flash Point: 183.4 °C; (8)Enthalpy of Vaporization: 64 kJ/mol; (9)Boiling Point: 379.6 °C at 760 mmHg; (10)Vapour Pressure: 3.91E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Clc1ccc(cc1)C(CN)c2ccccc2
(2)InChI: InChI=1/C14H14ClN.ClH/c15-13-8-6-12(7-9-13)14(10-16)11-4-2-1-3-5-11;/h1-9,14H,10,16H2;1H
(3)InChIKey: KYGYPNIZCSHFEW-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C14H14ClN.ClH/c15-13-8-6-12(7-9-13)14(10-16)11-4-2-1-3-5-11;/h1-9,14H,10,16H2;1H
(5)Std. InChIKey: KYGYPNIZCSHFEW-UHFFFAOYSA-N
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