DL-4-Thiazolylalanine supplier

Name
DL-4-Thiazolylalanine
EINECS
CAS No. 14717-97-6
Article Data4
CAS DataBase
Density 1.433 g/cm³
Solubility
Melting Point 237℃
Formula C₆H₈N₂O₂S
Boiling Point 353.32 °C at 760 mmHg
Molecular Weight 172.208
Flash Point 167.482 °C
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Synonyms 4-Thiazolepropanoicacid, a-amino-, (?à)-;4-Thiazolepropionic acid, a-amino-, DL- (8CI);4-Thiazolealanine;b-(4-Thiazolyl)-DL-Alanine;
PSA 104.45000
LogP 0.79780

DL-4-Thiazolylalanine Specification

The 4-Thiazolepropanoicacid, a-amino-, also known as DL-4-Thiazolylalanine, is the organic compound with the formula C₆H₈N₂O₂S. With the CAS registry number 14717-97-6, its IUPAC name is 2-amino-3-(1,3-thiazol-4-yl)propanoic acid.

Physical properties of 4-Thiazolepropanoicacid, a-amino-: (1)ACD/LogP: -0.65; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 4; (9)Index of Refraction: 1.616; (10)Molar Refractivity: 41.969 cm³; (11)Molar Volume: 120.14 cm³; (12)Surface Tension: 71.353 dyne/cm; (13)Density: 1.433 g/cm³; (14)Flash Point: 167.482 °C; (15)Enthalpy of Vaporization: 63.128 kJ/mol; (16)Boiling Point: 353.32 °C at 760 mmHg; (17)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C(N=CS1)CC(C(=O)O)N
(2)InChI: InChI=1S/C6H8N2O2S/c7-5(6(9)10)1-4-2-11-3-8-4/h2-3,5H,1,7H2,(H,9,10)
(3)InChIKey: WBZIGVCQRXJYQD-UHFFFAOYSA-N

Product Name

DL-4-Thiazolylalanine

DL-4-Thiazolylalanine Specification

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