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| CAS No.: | 68208-24-2 |
|---|---|
| Name: | 3-AMINO-3-(P-METHOXYPHENYL)-1-PROPANOL |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C10H16NO2+ |
| Molecular Weight: | 181.235 |
| Synonyms: | DL-BETA-(4-METHOXYPHENYL)ALANINOL;3-AMINO-3-(4-METHOXYPHENYL)-1-PROPANOL;3-AMINO-3-(4-METHOXY-PHENYL)-PROPAN-1-OL;3-AMINO-3-(P-METHOXYPHENYL)-1-PROPANOL;RARECHEM AM LA 0065;3-(4-METHOXYPHENYL)-DL-BETA-ALANINOL ;3-AMINO-3-(P-METHOXYPHENYL)-1-PROPANOL 98%;3-Amino-3-(p-methoxyphenyl)-1-propanol,98% |
| Density: | 1.1g/cm3 |
| Melting Point: | 82-86 °C |
| Boiling Point: | 334.2 °C at 760 mmHg |
| Flash Point: | 155.9 °C |
| Hazard Symbols: | C |
| Risk Codes: | 34 |
| Safety: | 45-36/37/39-26 |
| PSA: | 55.48000 |
| LogP: | 1.77770 |
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- Total:24 Page 1 of 1 1
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Specification
The systematic name of this chemical is [(1R)-3-Hydroxy-1-(4-methoxyphenyl)propyl]azanium. With the CAS registry number 68208-24-2, its molecular formula is C10H16NO2+ and molecular weight is 181.23. What's more, it should be stored in sealed container, and put in a cool and dry place.
Physical properties about this chemical are: (1)ACD/LogP: 0.51; (2)ACD/LogD (pH 5.5): -2.52; (3)ACD/LogD (pH 7.4): -1.41; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 18.46 Å2; (12)Flash Point: 155.9 °C; (13)Enthalpy of Vaporization: 60.92 kJ/mol; (14)Boiling Point: 334.2 °C at 760 mmHg; (15)Vapour Pressure: 5.14E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1)[C@H]([NH3+])CCO)C
(2)Std. InChI: InChI=1S/C10H15NO2/c1-13-9-4-2-8(3-5-9)10(11)6-7-12/h2-5,10,12H,6-7,11H2,1H3/p+1/t10-/m1/s1
(3)Std. InChIKey: WHWMCHUIUINGOD-SNVBAGLBSA-O