887375-49-7
ETHYL (2R)-2-HYDROXY-4-METHYL-2-(TRIFLUOROMETHYL)PENT-4-ENOATE
NameETHYL (2R)-2-HYDROXY-4-METHYL-2-(TRIFLUOROMETHYL)PENT-4-ENOATE
1Identification
【Name】
ETHYL (2R)-2-HYDROXY-4-METHYL-2-(TRIFLUOROMETHYL)PENT-4-ENOATE
【CAS】
【MDL】
MFCD16872043
【English Synonyms】
【Formula】
C9 H13 F3 O3
【MolWeight】
226.193
【Inchi】
InChI=1S/C9H13F3O3/c1-4-15-7(13)8(14,5-6(2)3)9(10,11)12/h14H,2,4-5H2,1,3H3/t8-/m1/s1
【InChIKey】
InChIKey=OUJRZMYAWPFRSV-MRVPVSSYSA-N
【SMILES】
CCOC(=O)[C@](CC(=C)C)(C(F)(F)F)O
【MOL File】
ETHYL (2R)-2-HYDROXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL (2R)-2-HYDROXY-4-METHYL-2-(TRIFLUOROMETHYL)PENT-4-ENOATE.cml