kessane

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(1S-(1alpha,4alpha, 5abeta,6alpha,8aalpha))-octahydro-1,3,3,6-tetramethyl-1,4-ethano-1H-cyclopent(c)oxepin

CAS: 3321-66-2 C15 H26 O MW: 222.37142000
All Ingredients Aromatic Ingredients CAS Numbers Found in Nature

Identification

Namekessane
CAS Number3321-66-2
FDA UNIISearch
Molecular FormulaC15 H26 O
Molecular Weight222.37142000

Regulatory

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 262.00 to 264.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.017000 mmHg @ 25.00 °C. (est)
Flash Point 208.00 °F. TCC ( 97.78 °C. )
logP (o/w) 4.983 (est)
Soluble in alcohol
Insoluble in water

No sensory data available

Safety Information

Oral/Parenteral ToxicityNot determined
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

Categorynatural substances and extractives
Recommendation for kessane usage levels up tonot for fragrance use.
Recommendation for kessane flavor usage levels up tonot for flavor use.

No supplier data available

Potential Uses

None Found

Natural Occurrence

valerian root oil @ 0.2-3.8% Data

Synonyms

(1S-(1alpha,4alpha, 5abeta,6alpha,8aalpha))- octahydro-1,3,3,6-tetramethyl-1,4-ethano-1H-cyclopent(c)oxepin PubMed: Terpenoid composition and antifungal activity of three commercially important essential oils against Aspergillus flavus and Aspergillus niger. PubMed: Volatile constituent distribution of Prangos coryombosa Boiss at two stages of growth. PubMed: Characterization of Szovitsia callicarpa volatile constituents obtained by micro- and hydrodistillation. PubMed: 25 years of natural product R&D with New South Wales agriculture. PubMed: Compositional diversity of terpenoids in the Himalayan Valeriana genera. PubMed: Synthesis of the reported structure of pogostol and a total aynthesis of (+/-)-kessane without the use of protecting groups. PubMed: Essential oil constituents of Valeriana italica and Valeriana tuberosa. Stereochemical and conformational study of 15-acetoxyvaleranone. PubMed: Antimalarial (+)-trans-hexahydrodibenzopyran derivatives from Machaerium multiflorum. PubMed: Antimicrobial activity and chemical composition of the bark oil of Croton stellulifer, an endemic species from S. Tomé e Príncipe. PubMed: Structure and absolute configuration of kessane. PubMed: Structure of kessane.