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Home > Nitro Compounds > 63228-64-8
63228-64-8 | Benzenesulfonamide, N-(4-methoxyphenyl)-2-nitro-
CAS No: 63228-64-8 Catalog No: AG00IB6A MDL No:MFCD00222039
Product Description
Catalog Number:
AG00IB6A
Chemical Name:
Benzenesulfonamide, N-(4-methoxyphenyl)-2-nitro-
CAS Number:
63228-64-8
Molecular Formula:
C13H12N2O5S
Molecular Weight:
308.3098
MDL Number:
MFCD00222039
IUPAC Name:
N-(4-methoxyphenyl)-2-nitrobenzenesulfonamide
InChI:
InChI=1S/C13H12N2O5S/c1-20-11-8-6-10(7-9-11)14-21(18,19)13-5-3-2-4-12(13)15(16)17/h2-9,14H,1H3
InChI Key:
UGQAMOBKUXTNCT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NS(=O)(=O)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.047g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.308g/mol
Monoisotopic Mass:
308.047g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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