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| Name |
Benzenemethanamine,2-(3-pyridinyl)-, hydrochloride (1:2) |
EINECS | N/A |
| CAS No. | 859833-18-4 | Density | N/A |
| PSA | 38.91000 | LogP | 4.51160 |
| Solubility | N/A | Melting Point |
265 °C |
| Formula | C12H12N2·2ClH | Boiling Point | 414.7 °C at 760 mmHg |
| Molecular Weight | 257.163 | Flash Point | 204.6 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
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Hazard Symbols |
 T
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| Synonyms |
Benzenemethanamine,2-(3-pyridinyl)-, dihydrochloride (9CI);1-(2-Pyridin-3-ylphenyl)methanamine dihydrochloride;1-(2-Pyridin-3-ylphenyl)methylamine dihydrochloride; |
Benzenemethanamine,2-(3-pyridinyl)-, hydrochloride (1:2) Specification
The Benzenemethanamine,2-(3-pyridinyl)-, hydrochloride (1:2), with the CAS registry number 859833-18-4, is also known as 1-(2-Pyridin-3-ylphenyl)methylamine dihydrochloride. This chemical's molecular formula is C12H12N2·2ClH and molecular weight is 257.16. What's more, its systematic name is 1-(2-pyridin-3-ylphenyl)methanamine dihydrochloride.
Physical properties of Benzenemethanamine,2-(3-pyridinyl)-, hydrochloride (1:2) are: (1)ACD/LogP: 1.53; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 38.91 Å2; (7)Flash Point: 204.6 °C; (8)Enthalpy of Vaporization: 68.06 kJ/mol; (9)Boiling Point: 414.7 °C at 760 mmHg; (10)Vapour Pressure: 2.82E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.Cl.NCc1ccccc1c2cccnc2
(2)InChI: InChI=1S/C12H12N2.2ClH/c13-8-10-4-1-2-6-12(10)11-5-3-7-14-9-11;;/h1-7,9H,8,13H2;2*1H
(3)InChIKey: SSFBEGXFELCUJT-UHFFFAOYSA-N
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