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

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;Trans-trans-δ-Damascone;(E)-1-(2β,6,6-Trimethyl-3-cyclohexen-1α-yl)-2-buten-1-one;[1α(E),2β]-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;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
Molecular Weight:
192.3
MDL Number:
MOL File:
71048-82-3.mol
Last updated:2026-05-28 03:54:25

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

Boiling point 263.6±29.0 °C(Predicted)
Density 0.890±0.06 g/cm3(Predicted)
vapor pressure 2.72Pa at 23℃
storage temp. -20°C
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
Cosmetics Ingredients Functions PERFUMING
LogP 4.2 at 35℃
FDA UNII 7F4RIE5P7E
EPA Substance Registry System 2-Buten-1-one, 1-[(1R,2S)-2,6,6-trimethyl-3-cyclohexen-1-yl]-, (2E)-rel- (71048-82-3)
UNSPSC Code 41116107
NACRES NA.24

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)Environment (GHS09)
GHS07,GHS09
Signal word  Warning
Hazard statements  H302-H317-H410-H315-H400
Precautionary statements  P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P270-P301+P312-P330-P501-P273-P391-P501-P264-P280-P302+P352-P321-P332+P313-P362-P273-P391-P501
WGK Germany  WGK 3
TSCA  TSCA listed
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral
Aquatic Acute 1
Aquatic Chronic 1
Skin Irrit. 2
Skin Sens. 1
REACH Registrations Active

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

Uses

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034.
This CRM is traceable to primary material from an NMI, e.g. NIST or NMIJ.
Certified content by quantitative NMR incl. uncertainty and expiry date are given on the certificate.
Download your certificate at: http://www.sigma aldrich.com

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

[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-one)Related 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 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- [1α(E),2β]-1-(2,6,6-trimethylcyclohex-3-en-1-yl)but-2-en-1-one Trans-trans-δ-Damascone DELTA-DAMASCONE 71048-82-3