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| CAS No.: | 876-32-4 |
|---|---|
| Name: | 4-METHOXY-N-METHYLBENZYLAMINE HYDROCHLORIDE |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C9H14ClNO |
| Molecular Weight: | 187.669 |
| Synonyms: | Benzenemethanamine,4-methoxy-N-methyl-, hydrochloride (9CI);Benzylamine, p-methoxy-N-methyl-,hydrochloride (6CI,7CI,8CI); |
| Melting Point: | 176 °C |
| Boiling Point: | 261.2 °C at 760 mmHg |
| Flash Point: | 111.8 °C |
| Hazard Symbols: |
 C
|
| PSA: | 21.26000 |
| LogP: | 2.60750 |
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- 90221-55-92-bromo-5-methylbenzaldehyde
- 885590-99-82,3-DIFLUORO-4-IODOBENZALDEHYDE
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- 926293-55-26-Bromo-2-methylpyridine-3-carboxaldehyde
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- Total:21 Page 1 of 1 1
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Specification
This chemical is called Benzenemethanamine,4-methoxy-N-methyl-, hydrochloride (1:1), and its systematic name is 1-(4-Methoxyphenyl)-N-methyl-methanamine hydrochloride. With the molecular formula of C9H14ClNO, its molecular weight is 187.67. The CAS registry number of this chemical is 876-32-4.
Other characteristics of the Benzenemethanamine,4-methoxy-N-methyl-, hydrochloride (1:1) can be summarised as followings: (1)ACD/LogP: 1.43; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 21.26 Å2; (7)Flash Point: 111.8 °C; (8)Enthalpy of Vaporization: 50.9 kJ/mol; (9)Boiling Point: 261.2 °C at 760 mmHg; (10)Vapour Pressure: 0.00919 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: CNCc1ccc(cc1)OC.Cl
2.InChI: InChI=1/C9H13NO.ClH/c1-10-7-8-3-5-9(11-2)6-4-8;/h3-6,10H,7H2,1-2H3;1H
3.InChIKey: NNANAKYVZOHKHW-UHFFFAOYAC