Home Carboxys 2-(pyridin-2-yl)-1,3-thiazole-5-carboxylic acid

2-(pyridin-2-yl)-1,3-thiazole-5-carboxylic acid

CAS No.:
886370-83-8
Catalog Number:
AG01AA2Q
Molecular Formula:
C9H6N2O2S
Molecular Weight:
206.2211
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Product Description
Catalog Number:
AG01AA2Q
Chemical Name:
2-(pyridin-2-yl)-1,3-thiazole-5-carboxylic acid
CAS Number:
886370-83-8
Molecular Formula:
C9H6N2O2S
Molecular Weight:
206.2211
MDL Number:
MFCD07375358
IUPAC Name:
2-pyridin-2-yl-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C9H6N2O2S/c12-9(13)7-5-11-8(14-7)6-3-1-2-4-10-6/h1-5H,(H,12,13)
InChI Key:
VRFBRJSRHCNIAO-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(s1)c1ccccn1
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.219g/mol
Monoisotopic Mass:
206.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties