40050
3,5-Dimethylcyclohexanol
mixture of stereo isomers, ≥97.0% (GC)
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About This Item
Linear Formula:
(CH3)2C6H9OH
CAS Number:
Molecular Weight:
128.21
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
226-630-8
Beilstein/REAXYS Number:
2036694
MDL number:
Product Name
3,5-Dimethylcyclohexanol, mixture of stereo isomers, ≥97.0% (GC)
InChI key
WIYNOPYNRFPWNB-UHFFFAOYSA-N
InChI
1S/C8H16O/c1-6-3-7(2)5-8(9)4-6/h6-9H,3-5H2,1-2H3
SMILES string
CC1CC(C)CC(O)C1
assay
≥97.0% (GC)
refractive index
n20/D 1.455 (lit.)
n20/D 1.455
bp
185-186 °C (lit.)
mp
11-12 °C (lit.)
density
0.892 g/mL at 25 °C (lit.)
Quality Level
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Application
3,5-Dimethylcyclohexanol may be used in the preparation of 1-chloro-3,5-dimethylcyclohexane.
General description
3,5-Dimethylcyclohexanol has been reported to be present in the essential oil from Pouteria splendens leaves by GC-MS analysis.
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
165.2 °F - closed cup
flash_point_c
74 °C - closed cup
ppe
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Regulatory Information
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Genus Pouteria: Chemistry and biological activity.
Silva CAM, et al.
Revista Brasileira de Farmacognosia, 19(2A), 501-509 (2009)
Long-range proton hyperfine splittings in the epr spectra of cyclohexyl and alkylcyclohexyl radicals: ring inversion in the cyclohexyl radical.
Roberts BP and Steel AJ.
Journal of the Chemical Society. Perkin Transactions 1, 211, 2025-2029 (1992)
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