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1218-73-1 | 1H-Benzimidazole, 2-(methoxyphenylmethyl)-
CAS No: 1218-73-1 Catalog No: AG001620 MDL No:
Product Description
Catalog Number:
AG001620
Chemical Name:
1H-Benzimidazole, 2-(methoxyphenylmethyl)-
CAS Number:
1218-73-1
Molecular Formula:
C15H14N2O
Molecular Weight:
238.2845
IUPAC Name:
2-[methoxy(phenyl)methyl]-1H-benzimidazole
InChI:
InChI=1S/C15H14N2O/c1-18-14(11-7-3-2-4-8-11)15-16-12-9-5-6-10-13(12)17-15/h2-10,14H,1H3,(H,16,17)
InChI Key:
JWHGIUIPEAVZBN-UHFFFAOYSA-N
SMILES:
COC(c1nc2c([nH]1)cccc2)c1ccccc1
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.111g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.29g/mol
Monoisotopic Mass:
238.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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