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168967-40-6 | 1H-Imidazole, 1-cyclooctyl-
CAS No: 168967-40-6 Catalog No: AG001YF0 MDL No:MFCD28041163
Product Description
Catalog Number:
AG001YF0
Chemical Name:
1H-Imidazole, 1-cyclooctyl-
CAS Number:
168967-40-6
Molecular Formula:
C11H18N2
Molecular Weight:
178.2740
MDL Number:
MFCD28041163
IUPAC Name:
1-cyclooctylimidazole
InChI:
InChI=1S/C11H18N2/c1-2-4-6-11(7-5-3-1)13-9-8-12-10-13/h8-11H,1-7H2
InChI Key:
KMSLKJVJKLQNBB-UHFFFAOYSA-N
SMILES:
C1CCCCC(CC1)n1cncc1
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.147g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.279g/mol
Monoisotopic Mass:
178.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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