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87751-68-6 | Cyclohexanone, 2-(2,7-octadienyl)-
CAS No: 87751-68-6 Catalog No: AG004LJX MDL No:
Product Description
Catalog Number:
AG004LJX
Chemical Name:
Cyclohexanone, 2-(2,7-octadienyl)-
CAS Number:
87751-68-6
Molecular Formula:
C14H22O
Molecular Weight:
206.3239
IUPAC Name:
2-octa-2,7-dienylcyclohexan-1-one
InChI:
InChI=1S/C14H22O/c1-2-3-4-5-6-7-10-13-11-8-9-12-14(13)15/h2,6-7,13H,1,3-5,8-12H2
InChI Key:
GOVSDTACYXDECV-UHFFFAOYSA-N
SMILES:
C=CCCCC=CCC1CCCCC1=O
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.167g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.329g/mol
Monoisotopic Mass:
206.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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