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Molecule
Hydroxyethyl Vinyl Ether
CAS: 764-48-7 · C4H8O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 764-48-7
- Molecular Formula
- C4H8O2
- Molecular Mass
- 88.11 g/mol
Identifiers
CAS Registry Number
764-48-7
SMILES
C=COCCO
InChI Key
VUIWJRYTWUGOOF-UHFFFAOYSA-N
InChI
InChI=1S/C4H8O2/c1-2-6-4-3-5/h2,5H,1,3-4H2
Names and Synonyms
- Hydroxyethyl Vinyl Ether Synonym
- Ethanol, 2-(ethenyloxy)- Synonym
- Ethanol, 2-(vinyloxy)- Synonym
- 2-(Ethenyloxy)ethanol Synonym
- Ethylene glycol vinyl ether Synonym
- Ethylene glycol monovinyl ether Synonym
- 2-(Vinyloxy)ethanol Synonym
- 2-Hydroxyethyl vinyl ether Synonym
- Vinyloxyethanol Synonym
- Monovinyl glycol ether Synonym
- Hydroxyethyl vinyl ether Synonym
- 2-Vinyloxy-1-ethanol Synonym
- 2-(Ethenyloxy)ethan-1-ol Synonym
- 2-Ethenoxyethanol Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 88.11 g/mol | CAS Common Chemistry |
| 88.106 g/mol | RDKit | |
| Density | 0.98 g/cm³ | CAS Common Chemistry |
| 0.9821 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Boiling Point | 141.6 °C | CAS Common Chemistry |
| Canonical SMILES | OCCOC=C | CAS Common Chemistry |
| InChI | InChI=1S/C4H8O2/c1-2-6-4-3-5/h2,5H,1,3-4H2 | CAS Common Chemistry |
| InChI Key | InChIKey=VUIWJRYTWUGOOF-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Hydroxyethyl vinyl ether | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 29.46 Ų | RDKit |
| LogP | 0.13879999999999998 | RDKit |
| 0.1388 | RDKit | |
| Molar Refractivity | 23.234799999999993 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.5 | RDKit |
| Exact Mass | 88.052429496 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 88.11 g/mol; density = 0.980 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C4H8O2.
