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Home > Nitro Compounds > 19757-13-2
19757-13-2 | Sulfamide, N,N'-bis(4-nitrophenyl)-
CAS No: 19757-13-2 Catalog No: AG002AWT MDL No:
Product Description
Catalog Number:
AG002AWT
Chemical Name:
Sulfamide, N,N'-bis(4-nitrophenyl)-
CAS Number:
19757-13-2
Molecular Formula:
C12H10N4O6S
Molecular Weight:
338.2960
IUPAC Name:
4-nitro-N-[(4-nitrophenyl)sulfamoyl]aniline
InChI:
InChI=1S/C12H10N4O6S/c17-15(18)11-5-1-9(2-6-11)13-23(21,22)14-10-3-7-12(8-4-10)16(19)20/h1-8,13-14H
InChI Key:
AHQKAJFDGDOBMG-UHFFFAOYSA-N
SMILES:
O=S(=O)(Nc1ccc(cc1)[N+](=O)[O-])Nc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.032g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
338.294g/mol
Monoisotopic Mass:
338.032g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
158A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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