898777-81-6
ETHYL 5-OXO-5-(4-TRIFLUOROMETHYLPHENYL)VALERATE
NameETHYL 5-OXO-5-(4-TRIFLUOROMETHYLPHENYL)VALERATE
1Identification
【Name】
ETHYL 5-OXO-5-(4-TRIFLUOROMETHYLPHENYL)VALERATE
【CAS】
【MDL】
MFCD02261350
【English Synonyms】
【Formula】
C14 H15 F3 O3
【MolWeight】
288.263
【Inchi】
InChI=1S/C14H15F3O3/c1-2-20-13(19)5-3-4-12(18)10-6-8-11(9-7-10)14(15,16)17/h6-9H,2-5H2,1H3
【InChIKey】
InChIKey=LADJNFYCKXDRPS-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CCCC(=O)c1ccc(cc1)C(F)(F)F
【MOL File】
ETHYL 5-OXO-5-(4-TRI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 5-OXO-5-(4-TRIFLUOROMETHYLPHENYL)VALERATE.cml