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Home > Nitro Compounds > 102-38-5
102-38-5 | Formamide, N-(3-nitrophenyl)-
CAS No: 102-38-5 Catalog No: AG00068T MDL No:MFCD00017014
Product Description
Catalog Number:
AG00068T
Chemical Name:
Formamide, N-(3-nitrophenyl)-
CAS Number:
102-38-5
Molecular Formula:
C7H6N2O3
Molecular Weight:
166.1341
MDL Number:
MFCD00017014
IUPAC Name:
N-(3-nitrophenyl)formamide
InChI:
InChI=1S/C7H6N2O3/c10-5-8-6-2-1-3-7(4-6)9(11)12/h1-5H,(H,8,10)
InChI Key:
QCDUUALALDXTAD-UHFFFAOYSA-N
SMILES:
O=CNc1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.136g/mol
Monoisotopic Mass:
166.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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