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| CAS No.: | 68285-24-5 |
|---|---|
| Name: | (S)-1-(2-Methoxyphenyl)ethylamine |
| Article Data: | 31 |
| Molecular Structure: | |
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| Formula: | C9H13NO |
| Molecular Weight: | 151.208 |
| Synonyms: | Benzenemethanamine,2-methoxy-a-methyl-, (S)-;(-)-o-Methoxy-a-phenylethylamine;(-)-a-(o-Methoxyphenyl)ethylamine;(1S)-1-(2-Methoxyphenyl)ethanamine;(S)-1-(2-Methoxyphenyl)ethylamine;(S)-o-Methoxy-a-phenethylamine; |
| Density: | 1.003 g/cm3 |
| Boiling Point: | 244.1 °C at 760 mmHg |
| Flash Point: | 102.3°C |
| Solubility: | Soluble in water(22 g/L). |
| Hazard Symbols: | C |
| Risk Codes: | 20-34 |
| Safety: | 26-36/37/39-45 |
| PSA: | 35.25000 |
| LogP: | 2.41520 |
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- Total:36 Page 1 of 1 1
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Specification
The (S)-1-(2-Methoxyphenyl)ethylamine with the cas number 68285-24-5 is also called Benzenemethanamine,2-methoxy-a-methyl-, (S)-. Its molecular formula is C9H13NO. The Product Category is Amino Acid Derivatives. This chemical is sensitive to air.
The properties of the chemical are: (1)ACD/LogP: 1.35; (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: 12.47 Å2; (7)Index of Refraction: 1.522; (8)Molar Refractivity: 46.01 cm3; (9)Molar Volume: 150.6 cm3; (10)Polarizability: 18.24×10-24cm3; (11)Surface Tension: 35.6 dyne/cm; (12)Enthalpy of Vaporization: 48.11 kJ/mol; (13)Vapour Pressure: 0.031 mmHg at 25°C.
Preparation: This chemical can be prepared by 1-(2-methoxy-phenyl)-ethanone. This reaction needs reagent ammonium acetate, sodium cyanoborohydride and solvent methanol at Ambient temperature. The reaction time is 96 hours. The yield is 82%.
Uses: This chemical can react with oxoacetic acid methyl ester, to product methyl (1-o-methoxyphenylethylimino)acetate. This reaction needs reagent 4 Angstroem molecular sieves and solvent CH2Cl2 at temperature of 20 °C. The reaction time is 1.0 hours. The yield is 45%. This reaction is Condensation.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccccc1[C@@H](N)C)C
(2)InChI: InChI=1/C7H6INO2/c1-11-7(10)5-3-2-4-9-6(5)8/h2-4H,1H3
(3)InChIKey: VENQOHAPVLVQKV-ZETCQYMHBT