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Home > Imidazoles > 88854-00-6
88854-00-6 | 1H-Naphth[1,2-d]imidazole, 2-(4-methoxyphenyl)-
CAS No: 88854-00-6 Catalog No: AG0049ZH MDL No:
Product Description
Catalog Number:
AG0049ZH
Chemical Name:
1H-Naphth[1,2-d]imidazole, 2-(4-methoxyphenyl)-
CAS Number:
88854-00-6
Molecular Formula:
C18H14N2O
Molecular Weight:
274.3166
IUPAC Name:
2-(4-methoxyphenyl)-3H-benzo[e]benzimidazole
InChI:
InChI=1S/C18H14N2O/c1-21-14-9-6-13(7-10-14)18-19-16-11-8-12-4-2-3-5-15(12)17(16)20-18/h2-11H,1H3,(H,19,20)
InChI Key:
JFLVVMSYARPRCV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc2c([nH]1)c1ccccc1cc2
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.323g/mol
Monoisotopic Mass:
274.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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