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100056-75-5 | Cyclohexanone, 2-(2-cyclopenten-1-yl)-
CAS No: 100056-75-5 Catalog No: AG0000QM MDL No:
Product Description
Catalog Number:
AG0000QM
Chemical Name:
Cyclohexanone, 2-(2-cyclopenten-1-yl)-
CAS Number:
100056-75-5
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
IUPAC Name:
2-cyclopent-2-en-1-ylcyclohexan-1-one
InChI:
InChI=1S/C11H16O/c12-11-8-4-3-7-10(11)9-5-1-2-6-9/h1,5,9-10H,2-4,6-8H2
InChI Key:
PHOADYBSYARIQH-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1C1C=CCC1
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.248g/mol
Monoisotopic Mass:
164.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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