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(S)-3-Amino-3-(thiophen-3-yl)propanoic acid

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Name

(S)-3-Amino-3-(thiophen-3-yl)propanoic acid

EINECS N/A
CAS No. 773050-73-0 Density 1.345 g/cm3
PSA 91.56000 LogP 1.92290
Solubility N/A Melting Point N/A
Formula C7H9NO2S Boiling Point 332.7 °C at 760 mmHg
Molecular Weight 171.22 Flash Point 155 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 773050-73-0 ((S)-3-AMINO-3-(3-THIENYL)-PROPIONIC ACID) Hazard Symbols N/A
Synonyms

(S)-3-Amino-3-(3-thienyl)propanoicacid;

 

(S)-3-Amino-3-(thiophen-3-yl)propanoic acid Specification

The (S)-3-Amino-3-(thiophen-3-yl)propanoic acid with the cas number 773050-73-0 is also called 3-Thiophenepropanoicacid, b-amino-, (bS)-. Its molecular formula is C7H9NO2S. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 0.59; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 65.54 Å2; (7)Index of Refraction: 1.606; (8)Molar Refractivity: 43.92 cm3; (9)Molar Volume: 127.2 cm3; (10)Polarizability: 17.41×10-24cm3; (11)Surface Tension: 61.3 dyne/cm; (12)Enthalpy of Vaporization: 60.75 kJ/mol; (13)Vapour Pressure: 5.68×10-5 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C([O-])C[C@@H](c1ccsc1)[NH3+]
(2)InChI: InChI=1/C7H9NO2S/c8-6(3-7(9)10)5-1-2-11-4-5/h1-2,4,6H,3,8H2,(H,9,10)/t6-/m0/s1
(3)InChIKey: UPDVATYZQLTZOZ-LURJTMIEBH

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