1-Ethynyl-1-cyclohexanol

1-Ethynyl-1-cyclohexanol Basic information
Product Name:1-Ethynyl-1-cyclohexanol
Synonyms:1-ETHYNYLCYCLOHEXANOL;1-ETHYNYL-1-CYCLOHEXANOL;1-ETHINYL-1-CYCLOHEXANOL;TIMTEC-BB SBB008829;(1-Hydroxycyclohexyl)ethyne;1-ethvnvl-1-cvclohexanol;1-Ethynyl-1-hydroxycyclohexane;1-Ethynylcyclohexan-1-ol
CAS:78-27-3
MF:C8H12O
MW:124.18
EINECS:201-100-9
Product Categories:Biphenyl & Diphenyl ether;Acetylenes;Acetylenic Alcohols & Their Derivatives;Alkynes;Organic Building Blocks;Terminal;Building Blocks;Chemical Synthesis;Organic Building Blocks;POSS
Mol File:78-27-3.mol
1-Ethynyl-1-cyclohexanol Structure
1-Ethynyl-1-cyclohexanol Chemical Properties
Melting point 30-33 °C(lit.)
Boiling point 180 °C(lit.)
density 0.967 g/mL at 25 °C(lit.)
vapor pressure <1 mm Hg ( 20 °C)
refractive index 1.481-1.484
Fp 163 °F
storage temp. Store below +30°C.
solubility 10 g/L (20°C)
pka13.34±0.20(Predicted)
form Liquid After Melting
color Clear colorless to light yellow
PH7 (1g/l, H2O, 20℃)
explosive limit1.3-8.7%(V)
Water Solubility 10 g/L (20 ºC)
BRN 471404
InChIKeyQYLFHLNFIHBCPR-UHFFFAOYSA-N
LogP1.49 at 25℃
CAS DataBase Reference78-27-3(CAS DataBase Reference)
NIST Chemistry ReferenceCyclohexanol, 1-ethynyl-(78-27-3)
EPA Substance Registry SystemCyclohexanol, 1-ethynyl- (78-27-3)
Safety Information
Hazard Codes Xn,Xi
Risk Statements 21/22-36-36/37/38-20/21/22-36/38
Safety Statements 36/37-36/37/39-26-36-22
RIDADR UN 2811 6.1/PG 3
WGK Germany 1
RTECS GV9100000
Autoignition Temperature365 °C
TSCA Yes
HazardClass 6.1
PackingGroup III
HS Code 29061900
ToxicityLD50 orally in Rabbit: 583 mg/kg LD50 dermal Rabbit 973 mg/kg
MSDS Information
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1-Ethynyl-1-cyclohexanol Usage And Synthesis
Chemical PropertiesColorless liquid
UsesStabilization of chlorinated organic compounds, intermediate, corrosion inhibitor for mineral acids, medicine (sedative).
Uses1-Ethynyl-1-cyclohexanol (ECHO) can undergo acetylation in the presence of a catalytic amount of ruthenium chloride at room temperature. It can be used to synthesize novel organotellurium(IV) compounds with potent inhibitory activity towards Cathepsin B. The polymerization of ECHO by transition metal catalysts leads to the formation of poly(ECHO). It can also react with transition metal hydride complexes to form vinyl derivatives by inserting into the M-H bonds.
Synthesis Reference(s)Organic Syntheses, Coll. Vol. 3, p. 416, 1955
Synthetic Communications, 18, p. 131, 1988 DOI: 10.1080/00397918808077336
Flammability and ExplosibilityNonflammable
1,3-BIS(1'-HYDROXYCYCLOHEXYL)-1-PROPYNE 3-(1-METHOXY-CYCLOHEXYL)-1-PHENYL-PROPYNONE 1-ETHYNYL-2,2,6-TRIMETHYLCYCLOHEXANOL 1-Ethynyl-1-cyclohexanol 1-BUTEN-3-YNE Trimethylsilylacetylene 1-(3-PIPERIDINO-1-PROPYNYL)-1-CYCLOHEXANOL 1-Ethynyl-1-cyclohexanol acetate 1-(1-PROPYNYL)CYCLOHEXANOL 1-BUTYNYL-1-CYCLOHEXANOL Cyclohexanemethanol Cyclohexylbenzene Cyclohexanol Terciprazine Cyclohexylamine Cyclohexanone Molasses 1-Methylcyclohexanol

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