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Allyl Glycidyl Ether
CAS: 106-92-3 | C6H10O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
106-92-3
Molecular Formula:
C6H10O2
Molecular Weight:
114.14399999999999 g/mol
Names and Synonyms:
Allyl Glycidyl Ether
Oxirane, 2-[(2-propen-1-yloxy)methyl]-
Propane, 1-(allyloxy)-2,3-epoxy-
Oxirane, [(2-propenyloxy)methyl]-
2-[(2-Propen-1-yloxy)methyl]oxirane
Allyl 2,3-epoxypropyl ether
Allyl glycidyl ether
Glycidyl allyl ether
1,2-Epoxy-3-allyloxypropane
1-Allyloxy-2,3-epoxypropane
[(Allyloxy)methyl]oxirane
Glycidyl 2-propenyl ether
Allyl oxiranemethyl ether
(±)-Allyl glycidyl ether
[(2-Propenyloxy)methyl]oxirane
Denacol EX 111
AGE
NSC 18596
NSC 631
1-(2-Propenyloxy)-2,3-epoxypropane
A 32608
2-[(2-Propenyloxy)methyl]oxirane
2-(Allyloxymethyl)oxirane
2-[(Prop-2-en-1-yloxy)methyl]oxirane
AGE 500
Silong 191
2-(Prop-2-enoxymethyl)oxirane
Identifiers:
SMILES:
C=CCOCC1CO1
InChI:
InChI=1S/C6H10O2/c1-2-3-7-4-6-5-8-6/h2,6H,1,3-5H2
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 | 114.14399999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 114.06807956 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 8 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 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 | 21.759999999999998 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 0.5878 | RDKit |
| molecular_mass | 114.14 g/mol | Legacy Database |
| density | 0.97 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Allyl_glycidyl_ether None | Legacy Database |
| cas-boiling-point | 153.9 °C @ Press: 760 Torr None | Legacy Database |
| cas-canonical-smile | O(CC=C)CC1OC1 None | Legacy Database |
| cas-density | 0.9698 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C6H10O2/c1-2-3-7-4-6-5-8-6/h2,6H,1,3-5H2 None | Legacy Database |
| cas-inchi-key | InChIKey=LSWYGACWGAICNM-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | -100 °C None | Legacy Database |
| cas-name | Allyl glycidyl ether None | Legacy Database |
| wikipedia-name | Allyl glycidyl ether None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 30.755999999999986 | RDKit |
