73958-00-6
METHYL-(5S,6S)-EPOXY-11-OXO-(7E,9E)-UNDECADIENOATE
NameMETHYL-(5S,6S)-EPOXY-11-OXO-(7E,9E)-UNDECADIENOATE
1Identification
【Name】
METHYL-(5S,6S)-EPOXY-11-OXO-(7E,9E)-UNDECADIENOATE
【CAS】
【MDL】
MFCD00069402
【English Synonyms】
【Formula】
C12 H16 O4
【MolWeight】
224.254
【Inchi】
InChI=1S/C12H16O4/c1-15-12(14)8-5-7-11-10(16-11)6-3-2-4-9-13/h2-4,6,9-11H,5,7-8H2,1H3/b4-2+,6-3+/t10-,11-/m0/s1
【InChIKey】
InChIKey=VNDZNEGDVPXXAI-YVPVWAGGSA-N
【SMILES】
COC(=O)CCC[C@H]1[C@@H](O1)/C=C/C=C/C=O
【MOL File】
METHYL-(5S,6S)-EPOXY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL-(5S,6S)-EPOXY-11-OXO-(7E,9E)-UNDECADIENOATE.cml