33704-61-9
1,2,3,5,6,7-HEXAHYDRO-1,1,2,3,3-PENTAMETHYL-4H-INDEN-4-ONE
Name1,2,3,5,6,7-HEXAHYDRO-1,1,2,3,3-PENTAMETHYL-4H-INDEN-4-ONE
1Identification
【Name】
1,2,3,5,6,7-HEXAHYDRO-1,1,2,3,3-PENTAMETHYL-4H-INDEN-4-ONE
【CAS】
【MDL】
MFCD00216987
【English Synonyms】
【Formula】
C14 H22 O
【MolWeight】
206.327
【Inchi】
InChI=1S/C14H22O/c1-9-13(2,3)10-7-6-8-11(15)12(10)14(9,4)5/h9H,6-8H2,1-5H3
【InChIKey】
InChIKey=MIZGSAALSYARKU-UHFFFAOYSA-N
【SMILES】
CC1C(C2=C(C1(C)C)C(=O)CCC2)(C)C
【MOL File】
1,2,3,5,6,7-HEXAHYDR….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
1,2,3,5,6,7-HEXAHYDRO-1,1,2,3,3-PENTAMETHYL-4H-INDEN-4-ONE.cml