634196-85-3
METHYL 2-(4-(BENZYLOXY)PHENYL)-4-OXOBUTANOATE
NameMETHYL 2-(4-(BENZYLOXY)PHENYL)-4-OXOBUTANOATE
1Identification
【Name】
METHYL 2-(4-(BENZYLOXY)PHENYL)-4-OXOBUTANOATE
【CAS】
【MDL】
MFCD17169888
【English Synonyms】
【Formula】
C18 H18 O4
【MolWeight】
298.336
【Inchi】
InChI=1S/C18H18O4/c1-21-18(20)17(11-12-19)15-7-9-16(10-8-15)22-13-14-5-3-2-4-6-14/h2-10,12,17H,11,13H2,1H3
【InChIKey】
InChIKey=ANNFUQJVOWDOJC-UHFFFAOYSA-N
【SMILES】
COC(=O)C(CC=O)c1ccc(cc1)OCc2ccccc2
【MOL File】
METHYL 2-(4-(BENZYLO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 2-(4-(BENZYLOXY)PHENYL)-4-OXOBUTANOATE.cml