Home Carboxys 4-(3-Nitrophenyl)thiazole-2-carboxylic acid

4-(3-Nitrophenyl)thiazole-2-carboxylic acid

CAS No.:
185245-05-0
Catalog Number:
AG003K1D
Molecular Formula:
C10H6N2O4S
Molecular Weight:
250.2306
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG003K1D
Chemical Name:
4-(3-Nitrophenyl)thiazole-2-carboxylic acid
CAS Number:
185245-05-0
Molecular Formula:
C10H6N2O4S
Molecular Weight:
250.2306
MDL Number:
MFCD18375282
IUPAC Name:
4-(3-nitrophenyl)-1,3-thiazole-2-carboxylic acid
InChI:
InChI=1S/C10H6N2O4S/c13-10(14)9-11-8(5-17-9)6-2-1-3-7(4-6)12(15)16/h1-5H,(H,13,14)
InChI Key:
FKODWVXNPSOFRQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1csc(n1)C(=O)O
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.005g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
250.228g/mol
Monoisotopic Mass:
250.005g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties