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84653-62-3 | Ethanone, 1-(3,4-dimethyl-6-methylene-3-cyclohexen-1-yl)-
CAS No: 84653-62-3 Catalog No: AG0050FG MDL No:
Product Description
Catalog Number:
AG0050FG
Chemical Name:
Ethanone, 1-(3,4-dimethyl-6-methylene-3-cyclohexen-1-yl)-
CAS Number:
84653-62-3
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
IUPAC Name:
1-(3,4-dimethyl-6-methylidenecyclohex-3-en-1-yl)ethanone
InChI:
InChI=1S/C11H16O/c1-7-5-9(3)11(10(4)12)6-8(7)2/h11H,3,5-6H2,1-2,4H3
InChI Key:
VQNXYKNCMNFUOO-UHFFFAOYSA-N
SMILES:
C=C1CC(=C(CC1C(=O)C)C)C
Properties
Complexity:
258
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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