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Home > Imidazoles > 108714-03-0
108714-03-0 | 1H-Benzimidazole, 2-[(4-methylphenyl)methyl]-
CAS No: 108714-03-0 Catalog No: AG0083A2 MDL No:
Product Description
Catalog Number:
AG0083A2
Chemical Name:
1H-Benzimidazole, 2-[(4-methylphenyl)methyl]-
CAS Number:
108714-03-0
Molecular Formula:
C15H14N2
Molecular Weight:
222.2851
IUPAC Name:
2-[(4-methylphenyl)methyl]-1H-benzimidazole
InChI:
InChI=1S/C15H14N2/c1-11-6-8-12(9-7-11)10-15-16-13-4-2-3-5-14(13)17-15/h2-9H,10H2,1H3,(H,16,17)
InChI Key:
HULPJQXXYCPOHN-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)Cc1nc2c([nH]1)cccc2
Properties
Complexity:
245
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:
1
Isotope Atom Count:
0
Molecular Weight:
222.291g/mol
Monoisotopic Mass:
222.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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