Home Carboxys 5-Phenylthiazole-4-carboxylic acid

5-Phenylthiazole-4-carboxylic acid

CAS No.:
13743-14-1
Catalog Number:
AG007LK9
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
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Product Description
Catalog Number:
AG007LK9
Chemical Name:
5-Phenylthiazole-4-carboxylic acid
CAS Number:
13743-14-1
Molecular Formula:
C10H7NO2S
Molecular Weight:
205.2331
MDL Number:
MFCD04186194
IUPAC Name:
5-phenyl-1,3-thiazole-4-carboxylic acid
InChI:
InChI=1S/C10H7NO2S/c12-10(13)8-9(14-6-11-8)7-4-2-1-3-5-7/h1-6H,(H,12,13)
InChI Key:
BIIMZWZUYMBFEV-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncsc1c1ccccc1
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.231g/mol
Monoisotopic Mass:
205.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties