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Molecule
Glycerol Triglycidyl Ether
CAS: 13236-02-7 · C12H20O6
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 13236-02-7
- Molecular Formula
- C12H20O6
- Molecular Mass
- 260.29 g/mol
Identifiers
CAS Registry Number
13236-02-7
SMILES
C(OCC1CO1)C(COCC1CO1)OCC1CO1
InChI Key
SYEWHONLFGZGLK-UHFFFAOYSA-N
InChI
InChI=1S/C12H20O6/c1(13-3-10-5-16-10)9(15-7-12-8-18-12)2-14-4-11-6-17-11/h9-12H,1-8H2
Names and Synonyms
- Glycerol Triglycidyl Ether Synonym
- Oxirane, 2,2′,2′′-[1,2,3-propanetriyltris(oxymethylene)]tris- Synonym
- Propane, 1,2,3-tris(2,3-epoxypropoxy)- Synonym
- 2,2′,2′′-[1,2,3-Propanetriyltris(oxymethylene)]tris[oxirane] Synonym
- Glycerin triglycidyl ether Synonym
- O,O′,O′′-Tris(β,γ-epoxypropyl)glycerol Synonym
- Tri-O-glycidylglycerol Synonym
- Glycerol tris(2,3-epoxypropyl) ether Synonym
- Glycerol triglycidyl ether Synonym
- T 55 Synonym
- 1,2,3-Tris(glycidyloxy)propane Synonym
- 1,2,3-Tris(2,3-epoxypropoxy)propane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 260.29 g/mol | CAS Common Chemistry |
| 260.28599999999994 g/mol | RDKit | |
| 260.286 g/mol | RDKit | |
| Canonical SMILES | O(CC(OCC1OC1)COCC2OC2)CC3OC3 | CAS Common Chemistry |
| InChI | InChI=1S/C12H20O6/c1(13-3-10-5-16-10)9(15-7-12-8-18-12)2-14-4-11-6-17-11/h9-12H,1-8H2 | CAS Common Chemistry |
| InChI Key | InChIKey=SYEWHONLFGZGLK-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Glycerol triglycidyl ether | CAS Common Chemistry |
| Heavy Atom Count | 18 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 11 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 65.28 Ų | RDKit |
| LogP | -0.39879999999999916 | RDKit |
| -0.3988 | RDKit | |
| Molar Refractivity | 60.59800000000005 cm³/mol | RDKit |
| Ring Count | 3 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 260.12598836 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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140
120
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20
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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 = 260.29 g/mol. Edit any field — others recompute live.
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