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89064-06-2 | 2-Cyclohexen-1-one, 3-methyl-4-(1-methylethenyl)-, (S)-
CAS No: 89064-06-2 Catalog No: AG0041AM MDL No:
Product Description
Catalog Number:
AG0041AM
Chemical Name:
2-Cyclohexen-1-one, 3-methyl-4-(1-methylethenyl)-, (S)-
CAS Number:
89064-06-2
Molecular Formula:
C10H14O
Molecular Weight:
150.2176
IUPAC Name:
(4S)-3-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-one
InChI:
InChI=1S/C10H14O/c1-7(2)10-5-4-9(11)6-8(10)3/h6,10H,1,4-5H2,2-3H3/t10-/m0/s1
InChI Key:
CWRPSUHIWDAIBF-JTQLQIEISA-N
SMILES:
CC1=CC(=O)CC[C@H]1C(=C)C
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
150.104g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.221g/mol
Monoisotopic Mass:
150.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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