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Home > Nitro Compounds > 88918-72-3
88918-72-3 | Benzenemethanesulfonamide, 4-nitro-
CAS No: 88918-72-3 Catalog No: AG00494K MDL No:MFCD06661253
Product Description
Catalog Number:
AG00494K
Chemical Name:
Benzenemethanesulfonamide, 4-nitro-
CAS Number:
88918-72-3
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
MDL Number:
MFCD06661253
IUPAC Name:
(4-nitrophenyl)methanesulfonamide
InChI:
InChI=1S/C7H8N2O4S/c8-14(12,13)5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2,(H2,8,12,13)
InChI Key:
VYLIVAAMSLPRIS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)CS(=O)(=O)N
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.211g/mol
Monoisotopic Mass:
216.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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