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Home > Nitro Compounds > 69754-50-3
69754-50-3 | Benzamide, N-(3-methylphenyl)-3-nitro-
CAS No: 69754-50-3 Catalog No: AG00IBZC MDL No:MFCD00437403
Product Description
Catalog Number:
AG00IBZC
Chemical Name:
Benzamide, N-(3-methylphenyl)-3-nitro-
CAS Number:
69754-50-3
Molecular Formula:
C14H12N2O3
Molecular Weight:
256.2567
MDL Number:
MFCD00437403
IUPAC Name:
N-(3-methylphenyl)-3-nitrobenzamide
InChI:
InChI=1S/C14H12N2O3/c1-10-4-2-6-12(8-10)15-14(17)11-5-3-7-13(9-11)16(18)19/h2-9H,1H3,(H,15,17)
InChI Key:
PZZACBBPLIOFMI-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)NC(=O)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
340
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.085g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.261g/mol
Monoisotopic Mass:
256.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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