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24780-82-3 | 1H-Benzimidazole, 6-methyl-1-(phenylmethyl)-
CAS No: 24780-82-3 Catalog No: AG002PFL MDL No:
Product Description
Catalog Number:
AG002PFL
Chemical Name:
1H-Benzimidazole, 6-methyl-1-(phenylmethyl)-
CAS Number:
24780-82-3
Molecular Formula:
C15H14N2
Molecular Weight:
222.2851
IUPAC Name:
1-benzyl-6-methylbenzimidazole
InChI:
InChI=1S/C15H14N2/c1-12-7-8-14-15(9-12)17(11-16-14)10-13-5-3-2-4-6-13/h2-9,11H,10H2,1H3
InChI Key:
PUWFVSWRUGFHTK-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)n(cn2)Cc1ccccc1
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.291g/mol
Monoisotopic Mass:
222.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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