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110011-62-6 | 1H-Benzimidazole, 2-(cyclohexylmethyl)-
CAS No: 110011-62-6 Catalog No: AG0084IO MDL No:
Product Description
Catalog Number:
AG0084IO
Chemical Name:
1H-Benzimidazole, 2-(cyclohexylmethyl)-
CAS Number:
110011-62-6
Molecular Formula:
C14H18N2
Molecular Weight:
214.3061
IUPAC Name:
2-(cyclohexylmethyl)-1H-benzimidazole
InChI:
InChI=1S/C14H18N2/c1-2-6-11(7-3-1)10-14-15-12-8-4-5-9-13(12)16-14/h4-5,8-9,11H,1-3,6-7,10H2,(H,15,16)
InChI Key:
SZJSSIDSLVUEES-UHFFFAOYSA-N
SMILES:
C1CCC(CC1)Cc1nc2c([nH]1)cccc2
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.147g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.312g/mol
Monoisotopic Mass:
214.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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