Basic information
- Name:
7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylicacid,3,4-bis(2-oxiranylmethyl) ester
- Superlist Name:
- Diglycidyl 4,5-epoxycyclohexane-1,2-dicarboxylate
- CAS No.:
25293-64-5
- Molecular Structure:
![Molecular Structure of 25293-64-5 (7-Oxabicyclo[4.1.0]heptane-3,4-dicarboxylicacid,3,4-bis(2-oxiranylmethyl) ester)](http://www.lookchem.com/300w/2010/077/25293-64-5.jpg)
- Formula:
- C14H18O7
- Molecular Weight:
- 298.29
- Synonyms:
- Bis(oxiran-2-ylmethyl) 7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylate;1-Propanol, 2,3-epoxy-,7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylate(2:1)(8CI);Diglycidyl 7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylate;
- Density:
- 1.406 g/cm3
- Boiling Point:
- 447.4 °C at 760 mmHg
- Flash Point:
- 200.6 °C
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Specification
The CAS registry number of Diglycidyl 4,5-epoxycyclohexane-1,2-dicarboxylate is 25293-64-5. The systematic name is 7-oxabicyclo[4.1.0]heptane-3,4-dicarboxylic acid, bis(oxiranylmethyl) ester. In addition, the molecular formula is C14H18O7 and the molecular weight is 298.29. It should be stored in cool and dry place.
Physical properties about Diglycidyl 4,5-epoxycyclohexane-1,2-dicarboxylate are: (1)ACD/LogP: 1.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.06; (4)ACD/LogD (pH 7.4): 1.06; (5)ACD/BCF (pH 5.5): 3.76; (6)ACD/BCF (pH 7.4): 3.76; (7)ACD/KOC (pH 5.5): 89.87; (8)ACD/KOC (pH 7.4): 89.87; (9)#H bond acceptors: 7; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 90.19 Å2; (13)Index of Refraction: 1.543; (14)Molar Refractivity: 66.91 cm3; (15)Molar Volume: 212 cm3; (16)Polarizability: 26.52×10-24cm3; (17)Surface Tension: 53.1 dyne/cm; (18)Density: 1.406 g/cm3; (19)Flash Point: 200.6 °C; (20)Enthalpy of Vaporization: 70.58 kJ/mol; (21)Boiling Point: 447.4 °C at 760 mmHg; (22)Vapour Pressure: 3.37E-08 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: C1C(C(CC2C1O2)C(=O)OCC3CO3)C(=O)OCC4CO4
(2)InChI: InChI=1/C14H18O7/c15-13(19-5-7-3-17-7)9-1-11-12(21-11)2-10(9)14(16)20-6-8-4-18-8/h7-12H,1-6H2
(3)InChIKey: ITZGNPZZAICLKA-UHFFFAOYAI