plum damascone (high alpha)

isodamascone (high alpha) (Symrise)

CAS: 39872-57-6 C13 H20 O MW: 192.30160000 fruity

Identification

Nameplum damascone (high alpha)
IUPAC(E)-1-(2,4,4-trimethylcyclohex-2-en-1-yl)but-2-en-1-one
CAS Number39872-57-6
EINECS254-663-8
FDA UNIISearch
Molecular FormulaC13 H20 O
Molecular Weight192.30160000
Nikkaji NumberJ261.465K

Regulatory

Physical Properties

Appearance colorless to pale yellow clear liquid (est)
Assay 90.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.91800 to 0.92600 @ 25.00 °C.
Pounds per Gallon - (est). 7.639 to 7.705
Refractive Index 1.48500 to 1.49300 @ 20.00 °C.
Boiling Point 266.00 to 267.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.008000 mmHg @ 25.00 °C. (est)
Vapor Density 6.7 ( Air = 1 )
Flash Point > 200.00 °F. TCC ( > 93.33 °C. )
logP (o/w) 3.436 (est)
Shelf Life 12.00 month(s) or longer if stored properly.
Storage store in cool, dry place in tightly sealed containers, protected from heat and light.
Soluble in alcohol
Insoluble in water

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

Organoleptic Properties

Odor Strength high ,
Substantivity 128 hour(s) at 100.00 %
Odor Description
at 10.00 % in dipropylene glycol.
radiant floral-fruity, rosy

Safety Information

Oral/Parenteral Toxicityoral-rat LD50 6300 mg/kg
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryfragrance agents
RIFM Fragrance Material Safety AssessmentSearch
IFRA Critical EffectDermal sensitization
fragrance material specificationShould not be used as fragrance ingredients such that the total level in finished cosmetic products exceeds 0.02%, individually or in combination. Based on test data showing sensitising potential for these materials and on evidence of cross-reactivity. (IFRA guidelines)
IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%)Category 1: Products applied to the lips
NotesIFRA FLAVOR REQUIREMENTS:
use level in formulae for use in cosmetics0.0380 %
Dermal Systemic Exposure in Cosmetic Products0.0010 mg/kg/day (IFRA, 2002)
Recommendation for plum damascone (high alpha) flavor usage levels up tonot for flavor use.

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Vigon International

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Potential Uses

FR floral FR plum FR rose FR tobacco

Natural Occurrence

not found in nature

Synonyms

2- buten-1-one, 1-(2,4,4-trimethyl-2-cyclohexen-1-yl)-, (2E)- 2- buten-1-one, 1-(2,4,4-trimethyl-2-cyclohexen-1-yl)-, (E)- iso damascone (high alpha) (Symrise) iso damascone (Symrise) plum damascone (high alpha) (E)- rose ketone-5 (E)-1-(2,4,4- trimethyl-2-cyclohexen-1-yl)-2-buten-1-one (E)-(2,4,4- trimethyl-2-cyclohexenyl)-2-butenone trans-(2,4,4- trimethyl-2-cyclohexenyl)-2-butenone (2E)-1-(2,4,4- trimethylcyclohex-2-en-1-yl)but-2-en-1-one (E)-1-(2,4,4- trimethylcyclohex-2-en-1-yl)but-2-en-1-one Try the PubMed Search.