79669-87-7
11-OXO-6,11-DIHYDRO-DIBENZO[B,E]OXEPINE-2-CARBOXYLIC ACID METHYL ESTER
Name
11-OXO-6,11-DIHYDRO-DIBENZO[B,E]OXEPINE-2-CARBOXYLIC ACID METHYL ESTER
Formula
C16 H12 O4
MolWeight
268.267
1Identification
【Name】
11-OXO-6,11-DIHYDRO-DIBENZO[B,E]OXEPINE-2-CARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD00243419
【English Synonyms】
【Formula】
C16 H12 O4
【MolWeight】
268.267
【Inchi】
InChI=1S/C16H12O4/c1-19-16(18)10-6-7-14-13(8-10)15(17)12-5-3-2-4-11(12)9-20-14/h2-8H,9H2,1H3
【InChIKey】
InChIKey=BCKOLYPIPZRJEL-UHFFFAOYSA-N
【SMILES】
COC(=O)c1ccc2c(c1)C(=O)c3ccccc3CO2
【MOL File】
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
11-OXO-6,11-DIHYDRO-DIBENZO[B,E]OXEPINE-2-CARBOXYLIC ACID METHYL ESTER.cml
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