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13060-28-1 | 1H-Benzimidazole, 2-dodecyl-
CAS No: 13060-28-1 Catalog No: AG0080M6 MDL No:
Product Description
Catalog Number:
AG0080M6
Chemical Name:
1H-Benzimidazole, 2-dodecyl-
CAS Number:
13060-28-1
Molecular Formula:
C19H30N2
Molecular Weight:
286.4549
IUPAC Name:
2-dodecyl-1H-benzimidazole
InChI:
InChI=1S/C19H30N2/c1-2-3-4-5-6-7-8-9-10-11-16-19-20-17-14-12-13-15-18(17)21-19/h12-15H,2-11,16H2,1H3,(H,20,21)
InChI Key:
QGFGLYOMJKJZIC-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1nc2c([nH]1)cccc2
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.241g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
286.463g/mol
Monoisotopic Mass:
286.241g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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