Home Carboxys 5-(3-fluorobenzamido)-3-methylthiophene-2-carboxylic acid

5-(3-fluorobenzamido)-3-methylthiophene-2-carboxylic acid

CAS No.:
926208-28-8
Catalog Number:
AG019UBV
Molecular Formula:
C13H10FNO3S
Molecular Weight:
279.2868
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Product Description
Catalog Number:
AG019UBV
Chemical Name:
5-(3-fluorobenzamido)-3-methylthiophene-2-carboxylic acid
CAS Number:
926208-28-8
Molecular Formula:
C13H10FNO3S
Molecular Weight:
279.2868
MDL Number:
MFCD09046302
IUPAC Name:
5-[(3-fluorobenzoyl)amino]-3-methylthiophene-2-carboxylic acid
InChI:
InChI=1S/C13H10FNO3S/c1-7-5-10(19-11(7)13(17)18)15-12(16)8-3-2-4-9(14)6-8/h2-6H,1H3,(H,15,16)(H,17,18)
InChI Key:
FVCZUJLHRJCQLC-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=O)Nc1cc(c(s1)C(=O)O)C
Properties
Complexity:
366  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.037g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
279.285g/mol
Monoisotopic Mass:
279.037g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties