143633-91-4
DIETHYL ALLYL(3-PHENYL-2-PROPYNYL)MALONATE
NameDIETHYL ALLYL(3-PHENYL-2-PROPYNYL)MALONATE
1Identification
【Name】
DIETHYL ALLYL(3-PHENYL-2-PROPYNYL)MALONATE
【CAS】
【MDL】
MFCD09953493
【English Synonyms】
【Formula】
C19 H22 O4
【MolWeight】
314.379
【Inchi】
InChI=1S/C19H22O4/c1-4-14-19(17(20)22-5-2,18(21)23-6-3)15-10-13-16-11-8-7-9-12-16/h4,7-9,11-12H,1,5-6,14-15H2,2-3H3
【InChIKey】
InChIKey=ZSPBIVGRCZUELN-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(CC=C)(CC#Cc1ccccc1)C(=O)OCC
【MOL File】
DIETHYL ALLYL(3-PHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
DIETHYL ALLYL(3-PHENYL-2-PROPYNYL)MALONATE.cml