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Diglycidyl Ether
CAS: 2238-07-5 | C6H10O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2238-07-5
Molecular Formula:
C6H10O3
Molecular Weight:
130.143 g/mol
Names and Synonyms:
Diglycidyl Ether
1,2,6,7-Diepoxy-4-oxaheptane
Di-2,3-epoxypropyl ether
Bis(2,3-epoxypropyl) ether
NSC 54739
Diglycidyl ether
2,2′-[Oxybis(methylene)]bis[oxirane]
Ether, bis(2,3-epoxypropyl)
Oxirane, 2,2′-[oxybis(methylene)]bis-
Identifiers:
SMILES:
C(OCC1CO1)C1CO1
InChI:
InChI=1S/C6H10O3/c1(5-3-8-5)7-2-6-4-9-6/h5-6H,1-4H2
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 130.143 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 130.06299418 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 9 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 3 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 4 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 34.29 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.19940000000000002 | RDKit |
| molecular_mass | 130.14 g/mol | Legacy Database |
| density | 1.12 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Diglycidyl_ether None | Legacy Database |
| cas-boiling-point | 260 °C @ Press: 760 Torr None | Legacy Database |
| cas-canonical-smile | O(CC1OC1)CC2OC2 None | Legacy Database |
| cas-density | 1.1195 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C6H10O3/c1(5-3-8-5)7-2-6-4-9-6/h5-6H,1-4H2 None | Legacy Database |
| cas-inchi-key | InChIKey=GYZLOYUZLJXAJU-UHFFFAOYSA-N None | Legacy Database |
| cas-name | 2,2′-[Oxybis(methylene)]bis[oxirane] None | Legacy Database |
| wikipedia-name | Diglycidyl ether None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 30.298999999999985 | RDKit |
