CAS No.43189-43-1,METHYL D-4-CHLOROPHENYLGLYCINATE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	43189-43-1
Name:	METHYL D-4-CHLOROPHENYLGLYCINATE
Article Data:	2

Formula:	C₉H₁₀ClNO₂
Molecular Weight:	199.637
Synonyms:	Methyl (2R)-amino(4-chlorophenyl)ethanoate;Methyl D-4-chlorophenylglycinate;(R)-Amino-(4-chloro-phenyl)-acetic acid methyl ester;
Density:	1.258 g/cm³
Boiling Point:	278.1 °C at 760 mmHg
Flash Point:	122 °C
PSA:	52.32000
LogP:	2.21310

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Specification

The Benzeneacetic acid, α-amino-4-chloro-, methyl ester, (αR)-, with the CAS registry number 43189-43-1, is also known as (R)-Amino-(4-chloro-phenyl)-acetic acid methyl ester. This chemical's molecular formula is C₉H₁₀ClNO₂ and molecular weight is 199.63. What's more, its systematic name is methyl (2R)-amino(4-chlorophenyl)ethanoate.

Physical properties of Benzeneacetic acid, α-amino-4-chloro-, methyl ester, (αR)- are: (1)ACD/LogP: 1.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.81; (4)ACD/LogD (pH 7.4): 1.69; (5)ACD/BCF (pH 5.5): 1.45; (6)ACD/BCF (pH 7.4): 11.11; (7)ACD/KOC (pH 5.5): 24.91; (8)ACD/KOC (pH 7.4): 190.18; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.551; (14)Molar Refractivity: 50.64 cm³; (15)Molar Volume: 158.6 cm³; (16)Polarizability: 20.07×10^-24cm³; (17)Surface Tension: 45.4 dyne/cm; (18)Density: 1.258 g/cm³; (19)Flash Point: 122 °C; (20)Enthalpy of Vaporization: 51.67 kJ/mol; (21)Boiling Point: 278.1 °C at 760 mmHg; (22)Vapour Pressure: 0.00434 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)[C@@H](N)C(=O)OC
(2)InChI: InChI=1S/C9H10ClNO2/c1-13-9(12)8(11)6-2-4-7(10)5-3-6/h2-5,8H,11H2,1H3/t8-/m1/s1
(3)InChIKey: WEWZTDMEYWXSRG-MRVPVSSYSA-N