-
Name
(S)-3-AMINO-3-(3,4-METHYLENEDIOXYPHENYL)PROPIONIC ACID
- EINECS
- CAS No. 723284-83-1
- Density 1.404 g/cm3
- Solubility
- Melting Point
- Formula C10H11NO4
- Boiling Point 381.9 °C at 760 mmHg
- Molecular Weight 209.20
- Flash Point 184.8 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
- Hazard Symbols
- Synonyms (S)-B-(P-METHYLENEDIOXYPHENYL)-B-ALANINE;(S)-3-AMINO-3-(4-METHYLENEDIOXYPHENYL)PROPIONIC ACID;(S)-3-AMINO-3-(BENZO[D][1,3]DIOXOL-5-YL)PROPANOIC ACID;(S)-3-AMINO-3-BENZO[1,3]DIOXOL-5-YL-PROPIONIC ACID;(S)-3-AMINO-3-(3,4-METHYLENEDIOXYPHENYL)PROPIONIC ACID;RARECHEM LK HC S236;(S)-3-Amino-3-(3,4-methylendioxyphenyl)propionic acid
- PSA 81.78000
- LogP 1.59010
(S)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid Specification
This chemical is called (S)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid, and its systematic name is (3S)-3-amino-3-(1,3-benzodioxol-5-yl)propanoic acid. With the molecular formula of C10H11NO4, its molecular weight is 209.20. The CAS registry number of this chemical is 723284-83-1, and its product category is API Intermediates.
Other characteristics of the (S)-3-Amino-3-benzo[1,3]dioxol-5-ylpropionic acid can be summarised as followings: (1)ACD/LogP: 0.77; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 48 Å2; (7)Index of Refraction: 1.61; (8)Molar Refractivity: 51.69 cm3; (9)Molar Volume: 148.9 cm3; (10)Polarizability: 20.49×10-24cm3; (11)Surface Tension: 68.4 dyne/cm; (12)Density: 1.404 g/cm3; (13)Flash Point: 184.8 °C; (14)Enthalpy of Vaporization: 66.48 kJ/mol; (15)Boiling Point: 381.9 °C at 760 mmHg; (16)Vapour Pressure: 1.63E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)C[C@@H](c1ccc2OCOc2c1)N/
2.InChI: InChI=1/C10H11NO4/c11-7(4-10(12)13)6-1-2-8-9(3-6)15-5-14-8/h1-3,7H,4-5,11H2,(H,12,13)/t7-/m0/s1
3.InChIKey: DJWMFJZOSZPAHI-ZETCQYMHBP
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