L-4-Chlorophenylglycine supplier

Name
(S)-AMINO-(4-CHLORO-PHENYL)-ACETIC ACID
EINECS
CAS No. 67336-19-0
Article Data7
CAS DataBase
Density 1.392 g/cm³
Solubility
Melting Point 229 °C
Formula C₈H₈ClNO₂
Boiling Point 328.8 ºC at 760 mmHg
Molecular Weight 185.61
Flash Point 152.7 ºC
Transport Information
Appearance
Safety 45
Risk Codes 25
Molecular Structure
Hazard Symbols T
Synonyms Benzeneacetic acid, α-amino-4-chloro-, (alphaS)-;(S)-2-Amino-2-(4-chlorophenyl)ethanoic acid;L-(4-Chlorophenyl)glycine;(S)-Amino-(4-chloro-phenyl)-acetic acid;(2S)-Amino(4-chlorophenyl)acetic acid;Parachlorophenylglycine;L-4-Cl-Phg-OH;
PSA 63.32000
LogP 2.12470

L-4-Chlorophenylglycine Specification

The Benzeneaceticacid, α-amino-4-chloro-, (αS)-, with the CAS registry number 62173-99-3, is also known as L-(4-Chlorophenyl)glycine. This chemical's molecular formula is C₈H₈ClNO₂ and molecular weight is 185.61. Its Systematic name is (2S)-amino(4-chlorophenyl)ethanoic acid.

Physical properties of Benzeneaceticacid, α-amino-4-chloro-, (αS)-: (1)ACD/LogP: 1.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.96; (4)ACD/LogD (pH 7.4): -0.96; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.603; (14)Molar Refractivity: 45.79 cm³; (15)Molar Volume: 133.2 cm³; (16)Surface Tension: 58.9 dyne/cm; (17)Density: 1.392 g/cm³; (18)Flash Point: 152.7 °C; (19)Enthalpy of Vaporization: 60.3 kJ/mol; (20)Boiling Point: 328.8 °C at 760 mmHg; (21)Vapour Pressure: 7.45E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: ClC1CCC(CC1)[C@H](N)C(=O)O
(2)InChI: InChI=1S/C8H8ClNO2/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7H,10H2,(H,11,12)/t7-/m0/s1
(3)InChIKey: QGJGBYXRJVIYGA-ZETCQYMHSA-N

Product Name

(S)-AMINO-(4-CHLORO-PHENYL)-ACETIC ACID

L-4-Chlorophenylglycine Specification

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