ChemicalBook > CAS DataBase List > [1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one

[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one

Product Name
[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one
CAS No.
71048-82-3
Chemical Name
[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one
Synonyms
DELTA-DAMASCONE;(E)-1-(2β,6,6-Trimethyl-3-cyclohexen-1α-yl)-2-buten-1-one;[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one;1a,2,3,4,4a,5,6,7b-octahydro-1,1,4,7-tetramethyl-1H-cylcoprop[e]azulene;2-Buten-1-one, 1-[(1R,2S)-2,6,6-trimethyl-3-cyclohexen-1-yl]-, (2E)-rel-;1-(2,6,6-trimethyl-3-cyclohexen-1-yl)-, [1.alpha.(E),2.beta.]-2-Buten-1-one
CBNumber
CB8939650
Molecular Formula
C13H20O
Formula Weight
192.3
MOL File
71048-82-3.mol
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[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one Property

Boiling point:
263.6±29.0 °C(Predicted)
Density 
0.890±0.06 g/cm3(Predicted)
vapor pressure 
2.72Pa at 23℃
Odor
at 1.00 % in dipropylene glycol. fruity sweet rose natural petal cassis black currant
Odor Type
floral
Water Solubility 
77.2mg/L at 20℃
JECFA Number
386
LogP
4.2 at 35℃
EPA Substance Registry System
2-Buten-1-one, 1-[(1R,2S)-2,6,6-trimethyl-3-cyclohexen-1-yl]-, (2E)-rel- (71048-82-3)
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H317May cause an allergic skin reaction

H400Very toxic to aquatic life

H410Very toxic to aquatic life with long lasting effects

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P270Do not eat, drink or smoke when using this product.

P272Contaminated work clothing should not be allowed out of the workplace.

P273Avoid release to the environment.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P321Specific treatment (see … on this label).

P330Rinse mouth.

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P333+P313IF SKIN irritation or rash occurs: Get medical advice/attention.

P362Take off contaminated clothing and wash before reuse.

P363Wash contaminated clothing before reuse.

P391Collect spillage. Hazardous to the aquatic environment

P501Dispose of contents/container to..…

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[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one Chemical Properties,Usage,Production

Synthesis Reference(s)

Tetrahedron Letters, 16, p. 515, 1975 DOI: 10.1016/S0040-4039(00)71908-3

Flammability and Explosibility

Not classified

[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one Preparation Products And Raw materials

Raw materials

Preparation Products

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[1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one Suppliers

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71048-82-3, [1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-oneRelated Search:


  • [1alpha(E),2beta]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one
  • 1a,2,3,4,4a,5,6,7b-octahydro-1,1,4,7-tetramethyl-1H-cylcoprop[e]azulene
  • DELTA-DAMASCONE
  • 1-(2,6,6-trimethyl-3-cyclohexen-1-yl)-, [1.alpha.(E),2.beta.]-2-Buten-1-one
  • (E)-1-(2β,6,6-Trimethyl-3-cyclohexen-1α-yl)-2-buten-1-one
  • 2-Buten-1-one, 1-[(1R,2S)-2,6,6-trimethyl-3-cyclohexen-1-yl]-, (2E)-rel-
  • 71048-82-3