3-Methylcyclohexanol
Synonym(s):3-Methylcyclohexanol
- CAS NO.：591-23-1
- Empirical Formula: C7H14O
- Molecular Weight: 114.19
- MDL number: MFCD00001446
- EINECS: 209-709-1
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-11-28 16:31:44
What is 3-Methylcyclohexanol?
Chemical properties
CLEAR COLOURLESS TO PALE YELLOW LIQUID
Synthesis Reference(s)
Tetrahedron Letters, 24, p. 4955, 1983 DOI: 10.1016/S0040-4039(01)99820-X
Purification Methods
Dry 3-methylcyclohexanol with Na2SO4 and fractionate it under vacuum. Note: The cis-isomer has b 173o/760mm, and the trans-isomer has b 168-169o/760mm. [Eliel & Haber J Org Chem 23 2041 1958, Beilstein 6 IV 102.]
Properties of 3-Methylcyclohexanol
| Melting point: | -74 °C |
| Boiling point: | 163 °C(lit.) |
| Density | 0.914 g/mL at 25 °C(lit.) |
| vapor pressure | 1.7 hPa (25 °C) |
| refractive index | n |
| Flash point: | 145 °F |
| storage temp. | Store below +30°C. |
| Water Solubility | Slightly soluble in water |
| form | clear liquid |
| pka | 15.32±0.40(Predicted) |
| color | Colorless to Almost colorless |
| Odor | at 100.00 %. dry solvent musty rummy fusel fruity |
| explosive limit | 1.3%(V) |
| BRN | 2036372 |
| Dielectric constant | 12.300000000000001 |
| CAS DataBase Reference | 591-23-1(CAS DataBase Reference) |
| EPA Substance Registry System | Cyclohexanol, 3-methyl- (591-23-1) |
Safety information for 3-Methylcyclohexanol
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 3-Methylcyclohexanol
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