Name: (S)-3-AMINO-3-(4-FLUORO-PHENYL)-PROPIONIC ACID
SKU: 151911-33-0

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Basic Information

Molecular Structure:
CAS No.:	151911-33-0
Name:	(S)-3-AMINO-3-(4-FLUORO-PHENYL)-PROPIONIC ACID
Article Data:	8

Formula:	C₉H₁₀FNO₂
Molecular Weight:	183.182
Synonyms:	Benzenepropanoicacid, b-amino-4-fluoro-, (S)-;(3S)-3-Amino-3-(4-fluorophenyl)propanoic acid;
Density:	1.29 g/cm³
Boiling Point:	308.829 °C at 760 mmHg
Flash Point:	140.575 °C
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	63.32000
LogP:	2.00050

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Specification

The CAS register number of (S)-beta-(4-Fluorophenyl)alanine is 151911-33-0. It also can be called as Benzenepropanoic acid, b-amino-4-fluoro-, (bS)- and the systematic name about this chemical is (3S)-3-amino-3-(4-fluorophenyl)propanoic acid. The molecular formula about this chemical is C₉H₁₀FNO₂and molecular weight is 183.18. It belongs to the following product categories, such as 3-Amino-3-phenylpropionic Acid Analogs; 3-Amino-3-phenylpropanoic Acid Analogs; B-Amino and so on.

Physical properties about (S)-beta-(4-Fluorophenyl)alanine are: (1)ACD/LogP: 0.96; (2)#H bond acceptors: 3; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 29.54Å²; (6)Index of Refraction: 1.554; (7)Molar Refractivity: 45.53 cm³; (8)Molar Volume: 142 cm³; (9)Polarizability: 18.05x10^-24cm³; (10)Surface Tension: 51.4 dyne/cm; (11)Enthalpy of Vaporization: 58.02 kJ/mol; (12)Boiling Point: 308.8 °C at 760 mmHg; (13)Vapour Pressure: 0.000287 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1)[C@@H](N)CC(=O)O
(2)InChI: InChI=1/C9H10FNO2/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
(3)InChIKey: CPGFMWPQXUXQRX-QMMMGPOBBD
(4)Std. InChI: InChI=1S/C9H10FNO2/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
(5)Std. InChIKey: CPGFMWPQXUXQRX-QMMMGPOBSA-N