898751-06-9
ETHYL 6-(3,5-DIMETHYL-4-METHOXYPHENYL)-6-OXOHEXANOATE
NameETHYL 6-(3,5-DIMETHYL-4-METHOXYPHENYL)-6-OXOHEXANOATE
1Identification
【Name】
ETHYL 6-(3,5-DIMETHYL-4-METHOXYPHENYL)-6-OXOHEXANOATE
【CAS】
【MDL】
MFCD01320203
【English Synonyms】
【Formula】
C17 H24 O4
【MolWeight】
292.373
【Inchi】
InChI=1S/C17H24O4/c1-5-21-16(19)9-7-6-8-15(18)14-10-12(2)17(20-4)13(3)11-14/h10-11H,5-9H2,1-4H3
【InChIKey】
InChIKey=VANWJYJPEQRGHD-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CCCCC(=O)c1cc(c(c(c1)C)OC)C
【MOL File】
ETHYL 6-(3,5-DIMETHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 6-(3,5-DIMETHYL-4-METHOXYPHENYL)-6-OXOHEXANOATE.cml