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(2-Methoxyethoxy)Ethene
CAS: 1663-35-0 | C5H10O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1663-35-0
Molecular Formula:
C5H10O2
Molecular Weight:
102.133 g/mol
Names and Synonyms:
(2-Methoxyethoxy)Ethene
1-(Ethenyloxy)-2-methoxyethane
1-Ethenoxy-2-methoxyethane
NSC 2143
2-Methoxyethyl vinyl ether
1-Methoxy-2-(vinyloxy)ethane
2-Methoxyethyl ethenyl ether
Vinyl 2-methoxyethyl ether
(2-Methoxyethoxy)ethene
Ethane, 1-methoxy-2-(vinyloxy)-
Ethene, (2-methoxyethoxy)-
Identifiers:
SMILES:
C=COCCOC
InChI:
InChI=1S/C5H10O2/c1-3-7-5-4-6-2/h3H,1,4-5H2,2H3
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 | 102.133 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 102.06807956 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 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 | 18.46 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 0.7928999999999999 | RDKit |
| molecular_mass | 102.13 g/mol | Legacy Database |
| density | 0.90 g/cm³ | Legacy Database |
| cas-boiling-point | 108.8 °C @ Press: 760 Torr None | Legacy Database |
| cas-canonical-smile | O(C=C)CCOC None | Legacy Database |
| cas-density | 0.897 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C5H10O2/c1-3-7-5-4-6-2/h3H,1,4-5H2,2H3 None | Legacy Database |
| cas-inchi-key | InChIKey=GXZPMXGRNUXGHN-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | -83 °C None | Legacy Database |
| cas-name | (2-Methoxyethoxy)ethene None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 28.024999999999988 | RDKit |
