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Molecule
CHVE
CAS: 2182-55-0 · C8H14O
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 2182-55-0
- Molecular Formula
- C8H14O
- Molecular Mass
- 126.20 g/mol
Identifiers
CAS Registry Number
2182-55-0
SMILES
C=COC1CCCCC1
InChI Key
VGIYPVFBQRUBDD-UHFFFAOYSA-N
InChI
InChI=1S/C8H14O/c1-2-9-8-6-4-3-5-7-8/h2,8H,1,3-7H2
Names and Synonyms
- CHVE Synonym
- Cyclohexyl Vinyl Ether Synonym
- Cyclohexane, (ethenyloxy)- Synonym
- Ether, cyclohexyl vinyl Synonym
- (Ethenyloxy)cyclohexane Synonym
- Cyclohexyl vinyl ether Synonym
- NSC 75856 Synonym
- (Cyclohexyloxy)ethene Synonym
- Vinyloxycyclohexane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 126.20 g/mol | CAS Common Chemistry |
| 126.19900000000001 g/mol | RDKit | |
| 126.199 g/mol | RDKit | |
| Density | 0.89 g/cm³ | CAS Common Chemistry |
| 0.8883 g/cm3 @ 420 °C | CAS Common Chemistry | |
| Boiling Point | 147-148 °C | CAS Common Chemistry |
| Canonical SMILES | O(C=C)C1CCCCC1 | CAS Common Chemistry |
| InChI | InChI=1S/C8H14O/c1-2-9-8-6-4-3-5-7-8/h2,8H,1,3-7H2 | CAS Common Chemistry |
| InChI Key | InChIKey=VGIYPVFBQRUBDD-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Cyclohexyl vinyl ether | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 9.23 Ų | RDKit |
| LogP | 2.4792000000000005 | RDKit |
| 2.4792 | RDKit | |
| 2.47 | chempirical lib | |
| Molar Refractivity | 38.155 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.75 | RDKit |
| Exact Mass | 126.104465068 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 = 126.20 g/mol; density = 0.890 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C8H14O.
