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Substance Name: 1,3-Cyclohexanedicarboxylic acid, 4-hydroxy-4-methyl-6-oxo-2-phenyl-, diethyl ester
RN: 17572-39-3
InChIKey: VDLSNXQRYWSHGB-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C19-H24-O6
Molecular Weight
- 348.393
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Names and Synonyms
Synonym
- Diethyl 4-hydroxy-4-methyl-6-oxo-2-phenyl-1,3-cyclohexanedicarboxylate
Systematic Name
- 1,3-Cyclohexanedicarboxylic acid, 4-hydroxy-4-methyl-6-oxo-2-phenyl-, diethyl ester
Registry Numbers
CAS Registry Number
- 17572-39-3
System Generated Number
- 0017572393
Structure Descriptors
InChI
1S/C19H24O6/c1-4-24-17(21)15-13(20)11-19(3,23)16(18(22)25-5-2)14(15)12-9-7-6-8-10-12/h6-10,14-16,23H,4-5,11H2,1-3H3InChIKey
VDLSNXQRYWSHGB-UHFFFAOYSA-NSmiles
C1(C[C@@]([C@@H]([C@@H]([C@@H]1C(=O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mammal (species unspecified) | LD50 | unreported | > 800mg/kg (800mg/kg) | Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 15, Pg. 359, 1977. |