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Home > Nitro Compounds > 84682-33-7
84682-33-7 | Benzamide,N-(4,4'-dinitro[1,1'-biphenyl]-2-yl)-
CAS No: 84682-33-7 Catalog No: AG004ZSI MDL No:
Product Description
Catalog Number:
AG004ZSI
Chemical Name:
Benzamide,N-(4,4'-dinitro[1,1'-biphenyl]-2-yl)-
CAS Number:
84682-33-7
Molecular Formula:
C19H13N3O5
Molecular Weight:
363.3236
IUPAC Name:
N-[5-nitro-2-(4-nitrophenyl)phenyl]benzamide
InChI:
InChI=1S/C19H13N3O5/c23-19(14-4-2-1-3-5-14)20-18-12-16(22(26)27)10-11-17(18)13-6-8-15(9-7-13)21(24)25/h1-12H,(H,20,23)
InChI Key:
SXHSXUJZDOVNJP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1)NC(=O)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]
EC Number:
283-596-7
Properties
Complexity:
545
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.086g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
363.329g/mol
Monoisotopic Mass:
363.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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