1,4-Cyclohexadiene-1,2-diacetic acid, 4,5-dimethyl-3,6-dioxo-, diphenyl ester
phenyl 2-[4,5-dimethyl-3,6-dioxo-2-(2-oxo-2-phenoxyethyl)cyclohexa-1,4-dien-1-yl]acetate
Also Known As: Diphenyl 4,5-dimethyl-3,6-dioxo-1,4-cyclohexadiene-1,2-diacetate|1,4-Cyclohexadiene-1,2-diacetic acid, 4,5-dimethyl-3,6-dioxo-, diphenyl ester|phenyl 2-[4,5-dimethyl-3,6-dioxo-2-(2-oxo-2-phenoxyethyl)cyclohexa-1,4-dien-1-yl]acetate|phenyl2-[4,5-dimethyl-3,6-dioxo-2- -1-cyclohexa-1,4-dienyl]acetate|1,4-Cyclohexadiene-1,2-diaceticacid, 4,5-dimethyl-3,6-dioxo-, 1,2-diphenyl ester|Diphenyl 2,2'-(4,5-dimethyl-3,6-dioxocyclohexa-1,4-diene-1,2-diyl)diacetate
| Molecular Formula | C24H20O6 |
|---|---|
| Molecular Weight | 404.12598 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 404.12598 |
| Monoisotopic Mass | 404.12598 |
| Heavy Atoms | 30 |
| Complexity | 712.0 |
Chemical Identifiers
| CAS Number | 64236-16-4 |
|---|---|
| SMILES | CC1=C(C(=O)C(=C(C1=O)CC(=O)OC2=CC=CC=C2)CC(=O)OC3=CC=CC=C3)C |
| InChIKey | YTRYZIQEUJQHCE-UHFFFAOYSA-N |
Product Overview
1,4-Cyclohexadiene-1,2-diacetic acid, 4,5-dimethyl-3,6-dioxo-, diphenyl ester (CAS 64236-16-4), with molecular formula C24H20O6 and molecular weight 404.12598 g/mol. IUPAC: phenyl 2-[4,5-dimethyl-3,6-dioxo-2-(2-oxo-2-phenoxyethyl)cyclohexa-1,4-dien-1-yl]acetate.
1,4-Cyclohexadiene-1,2-diacetic acid, 4,5-dimethyl-3,6-dioxo-, diphenyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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