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Home > Nitro Compounds > 119740-58-8
119740-58-8 | Phenol, 2-[[(2-methylphenyl)imino]methyl]-4-nitro-
CAS No: 119740-58-8 Catalog No: AG000PL1 MDL No:
Product Description
Catalog Number:
AG000PL1
Chemical Name:
Phenol, 2-[[(2-methylphenyl)imino]methyl]-4-nitro-
CAS Number:
119740-58-8
Molecular Formula:
C14H12N2O3
Molecular Weight:
256.2567
IUPAC Name:
2-[(2-methylphenyl)iminomethyl]-4-nitrophenol
InChI:
InChI=1S/C14H12N2O3/c1-10-4-2-3-5-13(10)15-9-11-8-12(16(18)19)6-7-14(11)17/h2-9,17H,1H3
InChI Key:
MNWNYDLYBIKUPW-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1C=Nc1ccccc1C)[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:
4
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:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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