140235-40-1
ETHYL (3R,5S)-6-HYDROXY-3,5-O-ISO-PROPYLIDENE-3,5-DIHYDROXYHEXANOATE
NameETHYL (3R,5S)-6-HYDROXY-3,5-O-ISO-PROPYLIDENE-3,5-DIHYDROXYHEXANOATE
1Identification
【Name】
ETHYL (3R,5S)-6-HYDROXY-3,5-O-ISO-PROPYLIDENE-3,5-DIHYDROXYHEXANOATE
【CAS】
【MDL】
MFCD03092960
【English Synonyms】
【Formula】
C11 H20 O5
【MolWeight】
232.274
【Inchi】
InChI=1S/C11H20O5/c1-4-14-10(13)6-8-5-9(7-12)16-11(2,3)15-8/h8-9,12H,4-7H2,1-3H3/t8-,9+/m1/s1
【InChIKey】
InChIKey=CHYUYMSRHNTVHQ-BDAKNGLRSA-N
【SMILES】
CCOC(=O)C[C@H]1C[C@H](OC(O1)(C)C)CO
【MOL File】
ETHYL (3R,5S)-6-HYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL (3R,5S)-6-HYDROXY-3,5-O-ISO-PROPYLIDENE-3,5-DIHYDROXYHEXANOATE.cml