58369-48-5
ETHYL-3-OXO-5-PHENYLPENT-4-ENOATE
NameETHYL-3-OXO-5-PHENYLPENT-4-ENOATE
1Identification
【Name】
ETHYL-3-OXO-5-PHENYLPENT-4-ENOATE
【CAS】
【MDL】
MFCD00087579
【English Synonyms】
【Formula】
C13 H14 O3
【MolWeight】
218.251
【Inchi】
InChI=1S/C13H14O3/c1-2-16-13(15)10-12(14)9-8-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3/b9-8+
【InChIKey】
InChIKey=KNUYHVRRBLEIHT-CMDGGOBGSA-N
【SMILES】
CCOC(=O)CC(=O)/C=C/c1ccccc1
【MOL File】
ETHYL-3-OXO-5-PHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL-3-OXO-5-PHENYLPENT-4-ENOATE.cml