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Home > Nitro Compounds > 80-37-5
80-37-5 | Benzenesulfonamide,N-(3-nitrophenyl)-
CAS No: 80-37-5 Catalog No: AG005B6J MDL No:MFCD00438172
Product Description
Catalog Number:
AG005B6J
Chemical Name:
Benzenesulfonamide,N-(3-nitrophenyl)-
CAS Number:
80-37-5
Molecular Formula:
C12H10N2O4S
Molecular Weight:
278.2838
MDL Number:
MFCD00438172
IUPAC Name:
N-(3-nitrophenyl)benzenesulfonamide
InChI:
InChI=1S/C12H10N2O4S/c15-14(16)11-6-4-5-10(9-11)13-19(17,18)12-7-2-1-3-8-12/h1-9,13H
InChI Key:
CWBLFCFUSMBFSO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)NS(=O)(=O)c1ccccc1
EC Number:
201-273-0
NSC Number:
29058
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.036g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.282g/mol
Monoisotopic Mass:
278.036g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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