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144449-66-1 | 1H-Benzimidazole, 2-(4-pentylphenyl)-
CAS No: 144449-66-1 Catalog No: AG001JJR MDL No:
Product Description
Catalog Number:
AG001JJR
Chemical Name:
1H-Benzimidazole, 2-(4-pentylphenyl)-
CAS Number:
144449-66-1
Molecular Formula:
C18H20N2
Molecular Weight:
264.3648
IUPAC Name:
2-(4-pentylphenyl)-1H-benzimidazole
InChI:
InChI=1S/C18H20N2/c1-2-3-4-7-14-10-12-15(13-11-14)18-19-16-8-5-6-9-17(16)20-18/h5-6,8-13H,2-4,7H2,1H3,(H,19,20)
InChI Key:
ZOUMSYKNGOLFMF-UHFFFAOYSA-N
SMILES:
CCCCCc1ccc(cc1)c1nc2c([nH]1)cccc2
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.163g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.372g/mol
Monoisotopic Mass:
264.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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