Methyl 2-oxocyclohexanecarboxylate , 95% , 41302-34-5

Synonym(s):
2-Methoxycarbonylcyclohexanone;Methyl cyclohexanone-2-carboxylate

CAS NO.：41302-34-5

Empirical Formula: C8H12O3

Molecular Weight: 156.18

MDL number: MFCD00077699

EINECS: 255-306-9

PRODUCT Properties

• Boiling point: 50 °C/0.2 mmHg (lit.)
• Density: 1.10 g/mL at 20 °C (lit.)
• refractive index: n20/D 1.483
• Flash point: 85 °C
• storage temp.: Inert atmosphere,Store in freezer, under -20°C
• form: Liquid
• pka: 12.04±0.20(Predicted)
• color: Clear colorless to slightly yellow
• BRN: 510258
• InChI: InChI=1S/C8H12O3/c1-11-8(10)6-4-2-3-5-7(6)9/h6H,2-5H2,1H3
• InChIKey: JEENWEAPRWGXSG-UHFFFAOYSA-N
• SMILES: C1(C(OC)=O)CCCCC1=O
• LogP: 0.290 (est)
• EPA Substance Registry System: Cyclohexanecarboxylic acid, 2-oxo-, methyl ester (41302-34-5)

Description and Uses

Methyl 2-oxocyclohexanecarboxylate has been used in the synthesis of substituted tetrahydrobenzofuran derivatives via reaction with propargylic esters in the presence of palladium catalyst.

Safety

• Safety Statements: 23-24/25
• RIDADR: NA 1993 / PGIII
• WGK Germany: 3
• HS Code: 29183000