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Home > Nitro Compounds > 15677-17-5
15677-17-5 | Phenol, 2-nitro-6-[(phenylimino)methyl]-
CAS No: 15677-17-5 Catalog No: AG001OZI MDL No:
Product Description
Catalog Number:
AG001OZI
Chemical Name:
Phenol, 2-nitro-6-[(phenylimino)methyl]-
CAS Number:
15677-17-5
Molecular Formula:
C13H10N2O3
Molecular Weight:
242.2301
IUPAC Name:
2-nitro-6-(phenyliminomethyl)phenol
InChI:
InChI=1S/C13H10N2O3/c16-13-10(5-4-8-12(13)15(17)18)9-14-11-6-2-1-3-7-11/h1-9,16H
InChI Key:
INLFWHLZZKENEJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1O)C=Nc1ccccc1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.069g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.234g/mol
Monoisotopic Mass:
242.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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