Methyl 4-ketocyclohexanecarboxylate supplier

Name
Methyl 4-ketocyclohexanecarboxylate
EINECS
CAS No. 6297-22-9
Article Data28
CAS DataBase
Density 1.111 g/cm³
Solubility
Melting Point
Formula C₈H₁₂O₃
Boiling Point 230.8 °C at 760 mmHg
Molecular Weight 156.181
Flash Point 94.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(Methoxycarbonyl)cyclohexanone;Methyl 4-ketocyclohexanecarboxylate;Methyl 4-oxocyclohexanecarboxylate;Methylcyclohexanone-4-carboxylate;NSC 17321;
PSA 43.37000
LogP 0.91870

Methyl 4-ketocyclohexanecarboxylate Specification

The Methyl 4-ketocyclohexanecarboxylate with its cas register number is 6297-22-9. It also can be called as 4-Oxocyclohexanecarboxylic acid methyl ester and the IUPAC Name about this chemical is methyl 4-oxocyclohexane-1-carboxylate. It belongs to the Drug Intermediates.

Physical properties about Methyl 4-ketocyclohexanecarboxylate are: (1)#H bond acceptors: 3; (2)#Freely Rotating Bonds: 2; (3)Polar Surface Area: 43.37Å²; (4)Index of Refraction: 1.463; (5)Molar Refractivity: 38.75 cm³; (6)Molar Volume: 140.5 cm³; (7)Polarizability: 15.36x10^-24cm³; (8)Surface Tension: 38.2 dyne/cm; (9)Enthalpy of Vaporization: 46.74 kJ/mol; (10)Vapour Pressure: 0.0646 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC(=O)C1CCC(=O)CC1
(2)InChI: InChI=1S/C8H12O3/c1-11-8(10)6-2-4-7(9)5-3-6/h6H,2-5H2,1H3
(3)InChIKey: BLYKGTCYDJZLFB-UHFFFAOYSA-N

Product Name

Methyl 4-ketocyclohexanecarboxylate

Methyl 4-ketocyclohexanecarboxylate Specification

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