1246616-66-9
4-Oxo-3-(phenylMethoxy)-4H-pyran-2,5-dicarboxylic acid 2,5-diMethyl ester
Name4-Oxo-3-(phenylMethoxy)-4H-pyran-2,5-dicarboxylic acid 2,5-diMethyl ester
1Identification
【Name】
4-Oxo-3-(phenylMethoxy)-4H-pyran-2,5-dicarboxylic acid 2,5-diMethyl ester
【CAS】
【MDL】
【English Synonyms】
【Formula】
C16H14O7
【MolWeight】
318.2782
【Inchi】
InChI=1S/C16H14O7/c1-20-15(18)11-9-23-14(16(19)21-2)13(12(11)17)22-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
【InChIKey】
InChIKey=REVROVKRCYLCAT-UHFFFAOYSA-N
【SMILES】
COC(=O)C=1OC=C(C(C1OCC1=CC=CC=C1)=O)C(=O)OC
【MOL File】
4-Oxo-3-(phenylMetho….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
4-Oxo-3-(phenylMethoxy)-4H-pyran-2,5-dicarboxylic acid 2,5-diMethyl ester.cml