562091-76-3
1-(2,2,6-TRIMETHYL-3-CYCLOHEXEN-1-YL)-ETHANONE
Name1-(2,2,6-TRIMETHYL-3-CYCLOHEXEN-1-YL)-ETHANONE
1Identification
【Name】
1-(2,2,6-TRIMETHYL-3-CYCLOHEXEN-1-YL)-ETHANONE
【CAS】
【MDL】
MFCD18829685
【English Synonyms】
【Formula】
C11 H18 O
【MolWeight】
166.262
【Inchi】
InChI=1S/C11H18O/c1-8-6-5-7-11(3,4)10(8)9(2)12/h5,7-8,10H,6H2,1-4H3
【InChIKey】
InChIKey=XTGNEGKUZLEJRU-UHFFFAOYSA-N
【SMILES】
CC1CC=CC(C1C(=O)C)(C)C
【MOL File】
1-(2,2,6-TRIMETHYL-3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2,2,6-TRIMETHYL-3-CYCLOHEXEN-1-YL)-ETHANONE.cml