58911-05-0
METHYL 1,4-DIMETHYLCYCLOHEX-3-ENE-1-CARBOXYLATE
NameMETHYL 1,4-DIMETHYLCYCLOHEX-3-ENE-1-CARBOXYLATE
1Identification
【Name】
METHYL 1,4-DIMETHYLCYCLOHEX-3-ENE-1-CARBOXYLATE
【CAS】
【MDL】
MFCD18974779
【English Synonyms】
【Formula】
C10 H16 O2
【MolWeight】
168.234
【Inchi】
InChI=1S/C10H16O2/c1-8-4-6-10(2,7-5-8)9(11)12-3/h4H,5-7H2,1-3H3
【InChIKey】
InChIKey=PAXHLOIQWUFMQI-UHFFFAOYSA-N
【SMILES】
CC1=CCC(CC1)(C)C(=O)OC
【MOL File】
METHYL 1,4-DIMETHYLC….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 1,4-DIMETHYLCYCLOHEX-3-ENE-1-CARBOXYLATE.cml