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CAS No.: | 72076-93-8 |
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Name: | 3-Amino-3-(4-hydroxy-3-methoxyphenyl)propionic acid |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C10H13NO4 |
Molecular Weight: | 211.218 |
Synonyms: | Benzenepropanoicacid, b-amino-4-hydroxy-3-methoxy-, (?à)-; |
Density: | 1.318 g/cm3 |
Boiling Point: | 401.6 °C at 760 mmHg |
Flash Point: | 196.7 °C |
PSA: | 92.78000 |
LogP: | 1.57560 |
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This chemical is called 3-Amino-3-(4-hydroxy-3-methoxyphenyl)propionic acid, and it can also be named as DL-beta-(4-Hydroxy-3-methoxy-phenyl)alanine. With the molecular formula of C10H13NO4, its molecular weight is 211.21. The CAS registry number of this chemical is 72076-93-8.
Other characteristics of the 3-Amino-3-(4-hydroxy-3-methoxyphenyl)propionic acid can be summarised as followings: (1)#H bond acceptors: 5; (2)#H bond donors: 4; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 92.78 Å2; (5)Index of Refraction: 1.59; (6)Molar Refractivity: 54.09 cm3; (7)Molar Volume: 160.2 cm3; (8)Polarizability: 21.44×10-24cm3; (9)Surface Tension: 59.3 dyne/cm; (10)Density: 1.318 g/cm3; (11)Flash Point: 196.7 °C; (12)Enthalpy of Vaporization: 68.83 kJ/mol; (13)Boiling Point: 401.6 °C at 760 mmHg; (14)Vapour Pressure: 3.58E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Oc1ccc(cc1OC)C(N)CC(O)=O
2.InChI: InChI=1/C10H13NO4/c1-15-9-4-6(2-3-8(9)12)7(11)5-10(13)14/h2-4,7,12H,5,11H2,1H3,(H,13,14)
3.InChIKey: IGHHJKPPALHKMJ-UHFFFAOYAV