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5851-50-3 | 2-Nonyl-1H-benzo[d]imidazole
CAS No: 5851-50-3 Catalog No: AG003HTE MDL No:MFCD00087614
Product Description
Catalog Number:
AG003HTE
Chemical Name:
2-Nonyl-1H-benzo[d]imidazole
CAS Number:
5851-50-3
Molecular Formula:
C16H24N2
Molecular Weight:
244.3752
MDL Number:
MFCD00087614
IUPAC Name:
2-nonyl-1H-benzimidazole
InChI:
InChI=1S/C16H24N2/c1-2-3-4-5-6-7-8-13-16-17-14-11-9-10-12-15(14)18-16/h9-12H,2-8,13H2,1H3,(H,17,18)
InChI Key:
YECSLYXTXWSKBO-UHFFFAOYSA-N
SMILES:
CCCCCCCCCc1nc2c([nH]1)cccc2
NSC Number:
74053
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.194g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.382g/mol
Monoisotopic Mass:
244.194g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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