Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Diethyl 2-cyclohexylpropanedioate |
EINECS | N/A |
CAS No. | 2163-44-2 | Density | 1.046 g/cm3 |
PSA | 52.60000 | LogP | 2.30910 |
Solubility | N/A | Melting Point |
115-135 °C |
Formula | C13H22O4 | Boiling Point | 297.2 °C at 760 mmHg |
Molecular Weight | 242.315 | Flash Point | 137 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC46843; |
Article Data | 24 |
The CAS registry number of Diethyl 2-cyclohexylpropanedioate is 2163-44-2. This chemical is also named as NSC46843. In addition, its molecular formula is C13H22O4 and molecular weight is 242.3114. Its IUPAC name is called diethyl 2-cyclohexylpropanedioate.
Physical properties about Diethyl 2-cyclohexylpropanedioate are: (1)ACD/LogP: 3.11; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 7; (6)Index of Refraction: 1.461; (7)Molar Refractivity: 63.61 cm3; (8)Molar Volume: 231.5 cm3; (9)Surface Tension: 36.2 dyne/cm; (10)Density: 1.046 g/cm3; (11)Flash Point: 137 °C; (12)Enthalpy of Vaporization: 53.7 kJ/mol; (13)Boiling Point: 297.2 °C at 760 mmHg; (14)Vapour Pressure: 0.00137 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)C(C(=O)OCC)C1CCCCC1
(2)InChI: InChI=1/C13H22O4/c1-3-16-12(14)11(13(15)17-4-2)10-8-6-5-7-9-10/h10-11H,3-9H2,1-2H3
(3)InChIKey: FUOPELSDMOAUBM-UHFFFAOYAY