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Molecule
Cyclohexyl Acrylate
CAS: 3066-71-5 · C9H14O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 3066-71-5
- Molecular Formula
- C9H14O2
- Molecular Mass
- 154.21 g/mol
Identifiers
CAS Registry Number
3066-71-5
SMILES
C=CC(=O)OC1CCCCC1
InChI Key
KBLWLMPSVYBVDK-UHFFFAOYSA-N
InChI
InChI=1S/C9H14O2/c1-2-9(10)11-8-6-4-3-5-7-8/h2,8H,1,3-7H2
Names and Synonyms
- Cyclohexyl Acrylate Synonym
- 2-Propenoic acid, cyclohexyl ester Synonym
- Acrylic acid, cyclohexyl ester Synonym
- Cyclohexyl acrylate Synonym
- Sartomer SR 220 Synonym
- SR 220 Synonym
- Viscoat 155 Synonym
- NSC 18612 Synonym
- Viscoat 115 Synonym
- V 155 Synonym
- Cyclohexyl 2-propenoate Synonym
- Blemmer CHA Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 154.21 g/mol | CAS Common Chemistry |
| 154.20899999999997 g/mol | RDKit | |
| 154.209 g/mol | RDKit | |
| Density | 0.97 g/cm³ | CAS Common Chemistry |
| 0.9705 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | O=C(OC1CCCCC1)C=C | CAS Common Chemistry |
| InChI | InChI=1S/C9H14O2/c1-2-9(10)11-8-6-4-3-5-7-8/h2,8H,1,3-7H2 | CAS Common Chemistry |
| InChI Key | InChIKey=KBLWLMPSVYBVDK-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Cyclohexyl acrylate | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 26.3 Ų | RDKit |
| LogP | 2.0483000000000002 | RDKit |
| 2.0483 | RDKit | |
| Molar Refractivity | 43.16200000000001 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.6667 | RDKit |
| 0.67 | chempirical lib | |
| Exact Mass | 154.099379688 g/mol | RDKit |
| Boiling Point | 75 °C @ 11 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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140
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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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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Quick conversion
MW = 154.21 g/mol; density = 0.970 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C9H14O2.
