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144344-59-2 | Benzoic acid, 4-[(2-phenyldiazenyl)(2-phenylhydrazinylidene)methyl]-
CAS No: 144344-59-2 Catalog No: AG001JDQ MDL No:
Product Description
Catalog Number:
AG001JDQ
Chemical Name:
Benzoic acid, 4-[(2-phenyldiazenyl)(2-phenylhydrazinylidene)methyl]-
CAS Number:
144344-59-2
Molecular Formula:
C20H16N4O2
Molecular Weight:
344.3666
IUPAC Name:
4-(N'-anilino-N-phenyliminocarbamimidoyl)benzoic acid
InChI:
InChI=1S/C20H16N4O2/c25-20(26)16-13-11-15(12-14-16)19(23-21-17-7-3-1-4-8-17)24-22-18-9-5-2-6-10-18/h1-14,21H,(H,25,26)
InChI Key:
ZXWJGTUVSGUXLR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1)C(=NNc1ccccc1)N=Nc1ccccc1
Properties
Complexity:
500
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.127g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
344.374g/mol
Monoisotopic Mass:
344.127g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.3
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