Home Halogens 3-[2-(4-bromophenyl)acetamido]thiophene-2-carboxylic acid

3-[2-(4-bromophenyl)acetamido]thiophene-2-carboxylic acid

CAS No.:
1016828-19-5
Catalog Number:
AG019UDT
Molecular Formula:
C13H10BrNO3S
Molecular Weight:
340.1924
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Product Description
Catalog Number:
AG019UDT
Chemical Name:
3-[2-(4-bromophenyl)acetamido]thiophene-2-carboxylic acid
CAS Number:
1016828-19-5
Molecular Formula:
C13H10BrNO3S
Molecular Weight:
340.1924
MDL Number:
MFCD09948668
IUPAC Name:
3-[[2-(4-bromophenyl)acetyl]amino]thiophene-2-carboxylic acid
InChI:
InChI=1S/C13H10BrNO3S/c14-9-3-1-8(2-4-9)7-11(16)15-10-5-6-19-12(10)13(17)18/h1-6H,7H2,(H,15,16)(H,17,18)
InChI Key:
RWOCJQKCBJGZJA-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccsc1C(=O)O)Cc1ccc(cc1)Br
Properties
Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.956g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
340.191g/mol
Monoisotopic Mass:
338.956g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
94.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties