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- 3-Methylcyclohexanol
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- $1.00
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2020-01-10
- CAS:591-23-1
- Min. Order: 1g
- Purity: 99.0%
- Supply Ability: 100kg
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| | 3-Methylcyclohexanol Basic information |
| Product Name: | 3-Methylcyclohexanol | | Synonyms: | 3-METHYLCYCLOHEXANOL;3-METHYLHEXALIN;3-METHYLCYCLOHEXANOL, 99%, MIXTURE OF CI S AND TRANS;3-methyl-cyclohexano;3-Methylcyclohexanol,c&t;3-methylcyclohexanol,mixtureofcisandtrans;Cyclohexanol, 3-methyl-;Cyclohexanol, m-methyl- | | CAS: | 591-23-1 | | MF: | C7H14O | | MW: | 114.19 | | EINECS: | 209-709-1 | | Product Categories: | | | Mol File: | 591-23-1.mol |  |
| | 3-Methylcyclohexanol Chemical Properties |
| 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 | n20/D 1.458(lit.) | | Fp | 145 °F | | storage temp. | Store below +30°C. | | Water Solubility | Slightly soluble in water | | pka | 15.32±0.40(Predicted) | | form | clear liquid | | color | Colorless to Almost colorless | | Odor | at 100.00 %. dry solvent musty rummy fusel fruity | | Odor Type | solvent | | explosive limit | 1.3%(V) | | BRN | 2036372 | | Henry's Law Constant | 2.9×100 mol/(m3Pa) at 25℃, Chao et al. (2017) | | Dielectric constant | 12.300000000000001 | | InChI | 1S/C7H14O/c1-6-3-2-4-7(8)5-6/h6-8H,2-5H2,1H3 | | InChIKey | HTSABYAWKQAHBT-UHFFFAOYSA-N | | SMILES | OC1CC(CCC1)C | | LogP | 1.818 (est) | | CAS DataBase Reference | 591-23-1(CAS DataBase Reference) | | EPA Substance Registry System | Cyclohexanol, 3-methyl- (591-23-1) |
| Hazard Codes | Xn | | Risk Statements | 20 | | Safety Statements | 24/25 | | WGK Germany | 1 | | RTECS | GW0200000 | | Autoignition Temperature | 295 °C | | TSCA | TSCA listed | | HS Code | 2906 12 00 | | Storage Class | 10 - Combustible liquids | | Hazard Classifications | Acute Tox. 4 Inhalation |
| | 3-Methylcyclohexanol Usage And Synthesis |
| Chemical Properties | CLEAR COLOURLESS TO PALE YELLOW LIQUID | | Uses | 3-Methylcyclohexanol is a cyclic secondary alcohol serves primarily as an intermediate in the synthesis of ketones, such as 3-methylcyclohexanone, a precursor for key compounds like isophorone. Its reactivity allows it to undergo transformations like oxidation, dehydration, and substitution, enabling the synthesis of diverse compounds. | | 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.] |
| | 3-Methylcyclohexanol Preparation Products And Raw materials |
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