21862-63-5

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21862-63-5 Structure

Identification	Back Directory
[Name] TRANS-4-TERT-BUTYLCYCLOHEXANOL
[CAS] 21862-63-5
[Synonyms] Butylcyclohexanol TRANS-4-TERT-BUTYLCYCLOHEXANOL (1α,4β)-4-tert-Butylcyclohexan-1-ol 1-dimethylethyl)-4-(trans-cyclohexano trans-4-tert-Butylcyclohexanol
[EINECS(EC#)] 700-127-8
[Molecular Formula] C10H20O
[MDL Number] MFCD00064952
[MOL File] 21862-63-5.mol
[Molecular Weight] 156.27

Chemical Properties	Back Directory
[Melting point ] 80 °C
[Boiling point ] 230.54°C (estimate)
[density ] 0.9052 (estimate)
[vapor pressure ] 0.74-29Pa at 20-50℃
[FEMA ] 4724 \| TRANS-4-TERT-BUTYLCYCLOHEXANOL
[refractive index ] 1.4583 (estimate)
[form ] Solid:flakes
[pka] 15.32±0.40(Predicted)
[Odor] at 10.00 % in dipropylene glycol. woody patchouli
[Odor Type] woody
[InChI] InChI=1S/C10H20O/c1-10(2,3)8-4-6-9(11)7-5-8/h8-9,11H,4-7H2,1-3H3/t8-,9-
[InChIKey] CCOQPGVQAWPUPE-KYZUINATSA-N
[SMILES] [C@@H]1(O)CC[C@@H](C(C)(C)C)CC1
[LogP] 3.42 at 25℃
[EPA Substance Registry System] Cyclohexanol, 4-(1,1-dimethylethyl)-, trans- (21862-63-5)

Hazard Information	Back Directory
[Chemical Properties] trans-4-tert-Butylcyclohexanol is a white crystals, insoluble in water, soluble in alcohol. At 10.00 % in dipropylene glycol. woody patchouli.
[Uses] trans-4-tert-Butylcyclohexanol is used as a reaction reagent and an intermediate in organic synthesis, mainly in chemical manufacturing or experimental research.

Spectrum Detail	Back Directory
[Spectrum Detail] TRANS-4-TERT-BUTYLCYCLOHEXANOL(21862-63-5)MS TRANS-4-TERT-BUTYLCYCLOHEXANOL(21862-63-5)¹HNMR TRANS-4-TERT-BUTYLCYCLOHEXANOL(21862-63-5)¹³CNMR TRANS-4-TERT-BUTYLCYCLOHEXANOL(21862-63-5)IR1 TRANS-4-TERT-BUTYLCYCLOHEXANOL(21862-63-5)IR2 TRANS-4-TERT-BUTYLCYCLOHEXANOL(21862-63-5)Raman

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