Home Other Building Blocks 3-(4-CHLOROPHENYL)-1,2-THIAZOLE-5-CARBOXYLIC ACID

3-(4-CHLOROPHENYL)-1,2-THIAZOLE-5-CARBOXYLIC ACID

CAS No.:
82424-97-3
Catalog Number:
AG01EKA0
Molecular Formula:
C10H6ClNO2S
Molecular Weight:
239.6781
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Product Description
Catalog Number:
AG01EKA0
Chemical Name:
3-(4-CHLOROPHENYL)-1,2-THIAZOLE-5-CARBOXYLIC ACID
CAS Number:
82424-97-3
Molecular Formula:
C10H6ClNO2S
Molecular Weight:
239.6781
MDL Number:
MFCD21304968
IUPAC Name:
3-(4-chlorophenyl)-1,2-thiazole-5-carboxylic acid
InChI:
InChI=1S/C10H6ClNO2S/c11-7-3-1-6(2-4-7)8-5-9(10(13)14)15-12-8/h1-5H,(H,13,14)
InChI Key:
ZCIWLUYSXPBTAP-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nsc(c1)C(=O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.981g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
239.673g/mol
Monoisotopic Mass:
238.981g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties