CAS No.266360-42-3,(S)-2-AMINO-3-(2,3-DIFLUORO-PHENYL)-PROPIONIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	266360-42-3
Name:	(S)-2-AMINO-3-(2,3-DIFLUORO-PHENYL)-PROPIONIC ACID
Article Data:	1

Formula:	C₉H₉F₂NO₂
Molecular Weight:	201.173
Synonyms:	dl-2,3-Difluorophenylalanine;(S)-2-Amino-3-(2,3-difluorophenyl)propanoic acid;
Density:	1.379 g/cm³
Boiling Point:	306.9 °C at 760 mmHg
Flash Point:	139.4 °C
PSA:	63.32000
LogP:	1.61950

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Specification

The L-Phenylalanine,2,3-difluoro-, with the CAS registry number 266360-42-3, is also known as (S)-2-Amino-3-(2,3-difluorophenyl)propanoic acid. This chemical's molecular formula is C₉H₉F₂NO₂ and molecular weight is 201.17. What's more, its systematic name is 2,3-difluorophenylalanine.

Physical properties of L-Phenylalanine,2,3-difluoro- are: (1)ACD/LogP: 1.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.37; (4)ACD/LogD (pH 7.4): -1.4; (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: 4; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.536; (14)Molar Refractivity: 45.48 cm³; (15)Molar Volume: 145.8 cm³; (16)Polarizability: 18.03×10^-24cm³; (17)Surface Tension: 49.1 dyne/cm; (18)Density: 1.379 g/cm³; (19)Flash Point: 139.4 °C; (20)Enthalpy of Vaporization: 57.8 kJ/mol; (21)Boiling Point: 306.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000327 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(cccc1F)CC(C(=O)O)N
(2)Std. InChI: InChI=1S/C9H9F2NO2/c10-6-3-1-2-5(8(6)11)4-7(12)9(13)14/h1-3,7H,4,12H2,(H,13,14)
(3)Std. InChIKey: KSUXKFDPNKLPHX-UHFFFAOYSA-N