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89565-48-0 | Benzenesulfonic acid, 4-[(3-nitrobenzoyl)amino]-, hydrazide
CAS No: 89565-48-0 Catalog No: AG003Y8Q MDL No:
Product Description
Catalog Number:
AG003Y8Q
Chemical Name:
Benzenesulfonic acid, 4-[(3-nitrobenzoyl)amino]-, hydrazide
CAS Number:
89565-48-0
Molecular Formula:
C13H12N4O5S
Molecular Weight:
336.3232
IUPAC Name:
N-[4-(hydrazinesulfonyl)phenyl]-3-nitrobenzamide
InChI:
InChI=1S/C13H12N4O5S/c14-16-23(21,22)12-6-4-10(5-7-12)15-13(18)9-2-1-3-11(8-9)17(19)20/h1-8,16H,14H2,(H,15,18)
InChI Key:
MGULWVNLADULIS-UHFFFAOYSA-N
SMILES:
NNS(=O)(=O)c1ccc(cc1)NC(=O)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
534
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.053g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
336.322g/mol
Monoisotopic Mass:
336.053g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
156A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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