911634-03-2
METHYL 11(R,S)-HYDROXY-14(S),15(S)-EPOXY-5(Z),8(Z),12(E)-EICOSATRIENOATE
Name
METHYL 11(R,S)-HYDROXY-14(S),15(S)-EPOXY-5(Z),8(Z),12(E)-EICOSATRIENOATE
Formula
C21 H34 O4
MolWeight
350.496
1Identification
【Name】
METHYL 11(R,S)-HYDROXY-14(S),15(S)-EPOXY-5(Z),8(Z),12(E)-EICOSATRIENOATE
【CAS】
【MDL】
MFCD04040012
【English Synonyms】
【Formula】
C21 H34 O4
【MolWeight】
350.496
【Inchi】
InChI=1S/C21H34O4/c1-3-4-10-14-19-20(25-19)17-16-18(22)13-11-8-6-5-7-9-12-15-21(23)24-2/h5,7-8,11,16-20,22H,3-4,6,9-10,12-15H2,1-2H3/b7-5-,11-8-,17-16+/t18?,19-,20-/m0/s1
【InChIKey】
InChIKey=MHXSCMMMTRMMBI-PUWVHZPJSA-N
【SMILES】
CCCCC[C@H]1[C@@H](O1)/C=C/C(C/C=C\C/C=C\CCCC(=O)OC)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
【Safety informationSymbol】
【Signal word】
【Hazard statements】
【Precautionary statements】
【hazard symbol】
【Risk Code】
【Safe Code】
【WGK Germany】
2
4CML File
METHYL 11(R,S)-HYDROXY-14(S),15(S)-EPOXY-5(Z),8(Z),12(E)-EICOSATRIENOATE.cml
Quick Release
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