Benzeneacetic acid, a-amino-3-chloro- supplier

Name
AMINO-(3-CHLORO-PHENYL)-ACETIC ACID
EINECS
CAS No. 7292-71-9
Article Data6
CAS DataBase
Density 1.392 g/cm³
Solubility
Melting Point 268-269℃ (decomposition)
Formula C₈H₈ClNO₂
Boiling Point 316.9 °C at 760 mmHg
Molecular Weight 185.61
Flash Point 145.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzeneaceticacid, a-amino-3-chloro-, (?à)-;Glycine, 2-(m-chlorophenyl)-,DL- (8CI);3-Chlorophenylglycine;DL-a-Amino-3-chlorophenylacetic acid;NSC 154922;Amino-(3-chloro-phenyl)-acetic acid;
PSA 63.32000
LogP 2.12470

Benzeneacetic acid, a-amino-3-chloro- Specification

The Benzeneacetic acid, a-amino-3-chloro-, with the CAS registry number 7292-71-9, is also known as 3-Chlorophenylglycine. It belongs to the product categories of Pharmaceutical Raw Materials; Pharmacetical. This chemical's molecular formula is C₈H₈ClNO₂ and formula weight is 185.61. What's more, its IUPAC name is 2-amino-2-(3-chlorophenyl)acetic acid.

Physical properties of Benzeneacetic acid, a-amino-3-chloro- are: (1)ACD/LogP: 1.54; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 29.54 Å²; (11)Index of Refraction: 1.603; (12)Molar Refractivity: 45.79 cm³; (13)Molar Volume: 133.2 cm³; (14)Surface Tension: 58.9 dyne/cm; (15)Density: 1.392 g/cm³; (16)Flash Point: 145.4 °C; (17)Enthalpy of Vaporization: 58.94 kJ/mol; (18)Boiling Point: 316.9 °C at 760 mmHg; (19)Vapour Pressure: 0.000168 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC(=C1)Cl)C(C(=O)O)
(2)InChI: InChI=1S/C8H8ClNO2/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7H,10H2,(H,11,12)
(3)InChIKey: MGOUENCSVMAGSE-UHFFFAOYSA-N

Product Name

AMINO-(3-CHLORO-PHENYL)-ACETIC ACID

Benzeneacetic acid, a-amino-3-chloro- Specification

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