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189329-94-0 | 3-Thiophenecarboxamide, 5-bromo-
CAS No: 189329-94-0 Catalog No: AG002IA9 MDL No:MFCD11644062
Product Description
Catalog Number:
AG002IA9
Chemical Name:
3-Thiophenecarboxamide, 5-bromo-
CAS Number:
189329-94-0
Molecular Formula:
C5H4BrNOS
Molecular Weight:
206.0604
MDL Number:
MFCD11644062
IUPAC Name:
5-bromothiophene-3-carboxamide
InChI:
InChI=1S/C5H4BrNOS/c6-4-1-3(2-9-4)5(7)8/h1-2H,(H2,7,8)
InChI Key:
ISXKVVQBTQEGSI-UHFFFAOYSA-N
SMILES:
Brc1scc(c1)C(=O)N
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.92g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.057g/mol
Monoisotopic Mass:
204.92g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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