C=CCC1CCCCC1=O
CAS: 94-66-6
Name: 2-prop-2-enylcyclohexan-1-one
SMILES: C=CCC1CCCCC1=O

Molecular Processing

Molecular formula
C9H14O
Molecular weight
138.21
Exact mass
138.1045
XLogP
2.32
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
10
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
41.78

Supplementary Information

InChIKey: UPGHEUSRLZSXAE-UHFFFAOYSA-N
Synonyme
2-Allylcyclohexanone94-66-6Cyclohexanone, 2-(2-propenyl)-2-Allylcyclohexan-1-oneCyclohexanone, 2-allyl-Cyclohexanone, 2-(2-propen-1-yl)-EINECS 202-352-2NSC 128921AI3-07009DTXSID90883283RefChem:580719Cyclohexanone, 2-allyl-(8CI)DTXCID901022826202-352-22-prop-2-enylcyclohexan-1-one2-(prop-2-en-1-yl)cyclohexan-1-oneMFCD00043548NSC-1289212-(2-Propenyl)cyclohexanoneNSC1289212-allyl cyclohexanone2-allyl-cyclohexanone2-allyl-cyclohexan-1-one2-Allylcyclohexanone, 97%KA2CS982EX2-(2-propenyl)-cyclohexanonSCHEMBL5289922-(2-Propen-1-yl)cyclohexanoneAAA09466SBB006544
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