Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Methyl 4-ketocyclohexanecarboxylate |
EINECS | N/A |
CAS No. | 6297-22-9 | Density | 1.111 g/cm3 |
PSA | 43.37000 | LogP | 0.91870 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H12O3 | Boiling Point | 230.8 °C at 760 mmHg |
Molecular Weight | 156.181 | Flash Point | 94.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-(Methoxycarbonyl)cyclohexanone;Methyl 4-ketocyclohexanecarboxylate;Methyl 4-oxocyclohexanecarboxylate;Methylcyclohexanone-4-carboxylate;NSC 17321; |
Article Data | 28 |
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