84006-52-0
2-((2-CYANO-3-PHENYL-1-OXO-2-PROPENYL)OXY)-1-METHYLPROPYL UNDECANOATE
Name2-((2-CYANO-3-PHENYL-1-OXO-2-PROPENYL)OXY)-1-METHYLPROPYL UNDECANOATE
1Identification
【Name】
2-((2-CYANO-3-PHENYL-1-OXO-2-PROPENYL)OXY)-1-METHYLPROPYL UNDECANOATE
【CAS】
【MDL】
MFCD01761308
【English Synonyms】
【Formula】
C25 H35 N O4
【MolWeight】
413.555
【Inchi】
InChI=1S/C25H35NO4/c1-4-5-6-7-8-9-10-14-17-24(27)29-20(2)21(3)30-25(28)23(19-26)18-22-15-12-11-13-16-22/h11-13,15-16,18,20-21H,4-10,14,17H2,1-3H3/b23-18+
【InChIKey】
InChIKey=FMVXJSPIXBVJDR-PTGBLXJZSA-N
【SMILES】
CCCCCCCCCCC(=O)OC(C)C(C)OC(=O)/C(=C/c1ccccc1)/C#N
【MOL File】
2-((2-CYANO-3-PHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-((2-CYANO-3-PHENYL-1-OXO-2-PROPENYL)OXY)-1-METHYLPROPYL UNDECANOATE.cml