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| CAS No.: | 2113-55-5 |
|---|---|
| Name: | M-XENYLAMINE HYDROCHLORIDE |
| Molecular Structure: | |
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| Formula: | C12H11N.ClH |
| Molecular Weight: | 205.68 |
| Synonyms: | 3-Biphenylamine,hydrochloride (7CI,8CI);[1,1'-Biphenyl]-3-amine, hydrochloride (9CI);3-Phenylaniline hydrochloride;m-Biphenylamine hydrochloride;Biphenyl-3-amine hydrochloride;3-Aminobiphenyl, HCl;M-Aminobiphenyl hydrochloride; |
| Density: | 1.077g/cm3 |
| Melting Point: | 199-200 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7)) |
| Boiling Point: | 370.2 °C at 760 mmHg |
| Flash Point: | 177.7 °C |
| PSA: | 26.02000 |
| LogP: | 4.31900 |
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- Total:28 Page 1 of 1 1
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Specification
This chemical is called [1,1'-Biphenyl]-3-amine,hydrochloride (1:1), and it can also be named as 3-Biphenylamine,hydrochloride. With the molecular formula of C12H11N.ClH, its molecular weight is 205.68. The CAS registry number of this chemical is 2113-55-5, and its systematic name is Biphenyl-3-amine hydrochloride.
Other characteristics of the [1,1'-Biphenyl]-3-amine,hydrochloride (1:1) can be summarised as followings: (1)ACD/LogP: 2.42; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 26.02 Å2; (7)Flash Point: 177.7 °C; (8)Enthalpy of Vaporization: 62.92 kJ/mol; (9)Boiling Point: 370.2 °C at 760 mmHg; (10)Vapour Pressure: 7.7E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Cl.Nc1cc(ccc1)c2ccccc2
2.InChI: InChI=1/C12H11N.ClH/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10;/h1-9H,13H2;1H
3.InChIKey: FFNBBUJVAUTTPK-UHFFFAOYAV