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67273-55-6 | 1H-Benzimidazole, 2-(4-ethylphenyl)-
CAS No: 67273-55-6 Catalog No: AG0062XU MDL No:
Product Description
Catalog Number:
AG0062XU
Chemical Name:
1H-Benzimidazole, 2-(4-ethylphenyl)-
CAS Number:
67273-55-6
Molecular Formula:
C15H14N2
Molecular Weight:
222.2851
IUPAC Name:
2-(4-ethylphenyl)-1H-benzimidazole
InChI:
InChI=1S/C15H14N2/c1-2-11-7-9-12(10-8-11)15-16-13-5-3-4-6-14(13)17-15/h3-10H,2H2,1H3,(H,16,17)
InChI Key:
SGMVEXZRDKPEJI-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1)c1nc2c([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:
4
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