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Home > Nitro Compounds > 82382-58-9
82382-58-9 | 2-Naphthalenecarboxamide, 3-hydroxy-N-(4-methoxy-2-nitrophenyl)-
CAS No: 82382-58-9 Catalog No: AG005C2J MDL No:
Product Description
Catalog Number:
AG005C2J
Chemical Name:
2-Naphthalenecarboxamide, 3-hydroxy-N-(4-methoxy-2-nitrophenyl)-
CAS Number:
82382-58-9
Molecular Formula:
C18H14N2O5
Molecular Weight:
338.3142
IUPAC Name:
3-hydroxy-N-(4-methoxy-2-nitrophenyl)naphthalene-2-carboxamide
InChI:
InChI=1S/C18H14N2O5/c1-25-13-6-7-15(16(10-13)20(23)24)19-18(22)14-8-11-4-2-3-5-12(11)9-17(14)21/h2-10,21H,1H3,(H,19,22)
InChI Key:
IAYYUHKCMUERMO-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1cc2ccccc2cc1O
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.09g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
338.319g/mol
Monoisotopic Mass:
338.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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