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Home > Pyridines > 140116-13-8
140116-13-8 | Phenol, 2-[[[5-(2-phenyldiazenyl)-2-pyridinyl]imino]methyl]-
CAS No: 140116-13-8 Catalog No: AG001C1E MDL No:
Product Description
Catalog Number:
AG001C1E
Chemical Name:
Phenol, 2-[[[5-(2-phenyldiazenyl)-2-pyridinyl]imino]methyl]-
CAS Number:
140116-13-8
Molecular Formula:
C18H14N4O
Molecular Weight:
302.3300
IUPAC Name:
2-[(5-phenyldiazenylpyridin-2-yl)iminomethyl]phenol
InChI:
InChI=1S/C18H14N4O/c23-17-9-5-4-6-14(17)12-19-18-11-10-16(13-20-18)22-21-15-7-2-1-3-8-15/h1-13,23H
InChI Key:
QVQJDGDOAJIXOG-UHFFFAOYSA-N
SMILES:
Oc1ccccc1C=Nc1ccc(cn1)N=Nc1ccccc1
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.117g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.337g/mol
Monoisotopic Mass:
302.117g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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