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Molecule
1,4-Cyclohexanedimethanol Diglycidyl Ether
CAS: 14228-73-0 · C14H24O4
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 14228-73-0
- Molecular Formula
- C14H24O4
- Molecular Mass
- 256.34 g/mol
Identifiers
CAS Registry Number
14228-73-0
SMILES
C1CC(COCC2CO2)CCC1COCC1CO1
InChI Key
VQMQXWYQIIUJIT-UHFFFAOYSA-N
InChI
InChI=1S/C14H24O4/c1-2-12(6-16-8-14-10-18-14)4-3-11(1)5-15-7-13-9-17-13/h11-14H,1-10H2
Names and Synonyms
- 1,4-Cyclohexanedimethanol Diglycidyl Ether Systematic Name
- Oxirane, 2,2′-[1,4-cyclohexanediylbis(methyleneoxymethylene)]bis- Synonym
- Cyclohexane, 1,4-bis[(2,3-epoxypropoxy)methyl]- Synonym
- 2,2′-[1,4-Cyclohexanediylbis(methyleneoxymethylene)]bis[oxirane] Synonym
- 1,4-Bis[(2,3-epoxypropoxy)methyl]cyclohexane Synonym
- 1,4-Bis(glycidoxymethyl)cyclohexane Synonym
- 1,4-Bis[(glycidyloxy)methyl]cyclohexane Synonym
- 1,4-Cyclohexanedimethanol diglycidyl ether Synonym
- 1,4-Bis(hydroxymethyl)cyclohexane diglycidyl ether Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 256.34 g/mol | CAS Common Chemistry |
| 256.3419999999999 g/mol | RDKit | |
| 256.342 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/1,4-Cyclohexanedimethanol_diglycidyl_ether | CAS Common Chemistry |
| Canonical SMILES | O(CC1OC1)CC2CCC(COCC3OC3)CC2 | CAS Common Chemistry |
| InChI | InChI=1S/C14H24O4/c1-2-12(6-16-8-14-10-18-14)4-3-11(1)5-15-7-13-9-17-13/h11-14H,1-10H2 | CAS Common Chemistry |
| InChI Key | InChIKey=VQMQXWYQIIUJIT-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 1,4-Cyclohexanedimethanol diglycidyl ether | CAS Common Chemistry |
| Heavy Atom Count | 18 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 8 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 43.519999999999996 Ų | RDKit |
| 43.52 Ų | RDKit | |
| LogP | 1.6236 | RDKit |
| Molar Refractivity | 66.56600000000006 cm³/mol | RDKit |
| Ring Count | 3 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 256.167459248 g/mol | RDKit |
| Boiling Point | 135 °C @ 0.12 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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200 ppm
180
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 256.34 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C14H24O4.
