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Home > Nitro Compounds > 39880-88-1
39880-88-1 | N-(4-nitrophenyl)thiophene-2-carboxamide
CAS No: 39880-88-1 Catalog No: AG00J00P MDL No:MFCD00171151
Product Description
Catalog Number:
AG00J00P
Chemical Name:
N-(4-nitrophenyl)thiophene-2-carboxamide
CAS Number:
39880-88-1
Molecular Formula:
C11H8N2O3S
Molecular Weight:
248.2578
MDL Number:
MFCD00171151
IUPAC Name:
N-(4-nitrophenyl)thiophene-2-carboxamide
InChI:
InChI=1S/C11H8N2O3S/c14-11(10-2-1-7-17-10)12-8-3-5-9(6-4-8)13(15)16/h1-7H,(H,12,14)
InChI Key:
FUSWAPGVSPAXMY-UHFFFAOYSA-N
SMILES:
O=C(c1cccs1)Nc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.026g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.256g/mol
Monoisotopic Mass:
248.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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