lavandulol
4-hexen-1-ol, 5-methyl-2-(1-methylethenyl)-
 
Notes:
None found
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5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol (Click)
CAS Number: 58461-27-1Picture of molecule
ECHA EINECS - REACH Pre-Reg: 261-264-2
Nikkaji Web: J296.944K
MDL: MFCD00674532
XlogP3-AA: 3.00 (est)
Molecular Weight: 154.25266000
Formula: C10 H18 O
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
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NCBI: Search
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 96.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.87850 @  25.00 °C.
Refractive Index: 1.46830 @  20.00 °C.
Boiling Point: 94.00 to  95.00 °C. @ 13.00 mm Hg
Boiling Point: 229.00 to  230.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.013000 mm/Hg @ 25.00 °C. (est)
Flash Point: 191.00 °F. TCC ( 88.33 °C. )
logP (o/w): 2.665 (est)
Soluble in:
 alcohol
 water, 253.2 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
Odor Type: floral
Odor Strength: medium
 floral  waxy  mimosa  herbal  
Odor Description:
at 100.00 %. 
delicate farnesol-like
  
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
Carbosynth
For experimental / research use only.
rac-Lavandulol
ExtraSynthese
For experimental / research use only.
(+/-)-Lavandulol (GC) ≥95%
Sigma-Aldrich
For experimental / research use only.
Lavandulol
analytical standard
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Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: fragrance agents
Recommendation for lavandulol usage levels up to:
  1.0000 % in the fragrance concentrate.
 
Recommendation for lavandulol flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA Substance Registry Services (TSCA): 58461-27-1
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 94060
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
Chemidplus: 0058461271
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References:
Leffingwell: chirality
 5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 58461-27-1
Pubchem (cid): 94060
Pubchem (sid): 135051909
Pherobase: View
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
CHEBI: View
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2905.20
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
Wikipedia: View
RSC Learn Chemistry: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 artemisia santolina schrenk oil iran @ 37.20%
Data  GC  Search Trop  Picture
 curry leaf oil india @ 0.10%
Data  GC  Search Trop  Picture
 lavandin oil abrialis @ 0.55%
Data  GC  Search Trop  Picture
 lavandin oil grosso @ 0.84%
Data  GC  Search Trop  Picture
 lavandin water (lavandula hydrida) @ 1.36%
Data  GC  Search Trop  Picture
 lavender
Search Trop  Picture
 lavender oil CO2 extract france @ 0.31%
Data  GC  Search Trop  Picture
 lavender oil greece @ 3.09%
Data  GC  Search Trop  Picture
 lavender oil spike france @ 0.50%
Data  GC  Search Trop  Picture
 lavender spike water @ 0.05%
Data  GC  Search Trop  Picture
 lavender water bulgaria @ 2.87%
Data  GC  Search Trop  Picture
 rosemary oil france @ 0.00-0.06%
Data  GC  Search Trop  Picture
 rosemary oil morocco @ 0.00-0.23%
Data  GC  Search Trop  Picture
 wormwood oil america @ 0.71%
Data  GC  Search Trop  Picture
 yarrow oil @ 2.00%
Data  GC  Search Trop  Picture
 yarrow oil greece @ 0.10%
Data  GC  Search Trop  Picture
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Synonyms:
4-hexen-1-ol, 2-isopropenyl-5-methyl-, (-)-
4-hexen-1-ol, 5-methyl-2-(1-methylethenyl)-
 lavandulol
(±)-lavandulol
5-methyl-2-(1-methyl ethenyl)-4-hexen-1-ol
5-methyl-2-(1-methylethenyl)hex-4-en-1-ol
5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-ol
5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
isopropenyl methyl hexenol
2-isopropenyl-5-methyl hex-4-en-1-ol
2-isopropenyl-5-methyl-4-hexen-1-ol
2-isopropenyl-5-methylhex-4-en-1-ol
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Articles:
PubMed: Transformation of (±)-lavandulol and (±)-tetrahydrolavandulol by a fungal strain Rhizopus oryzae.
PubMed: Selective deoxygenation of allylic alcohol: stereocontrolled synthesis of lavandulol.
PubMed: One-Pot synthesis of gamma,delta-unsaturated carbonyl compounds from allyl alcohols and vinyl or isopropenyl acetates catalyzed by [IrCl(cod)]2.
PubMed: Enzymatic esterification of lavandulol--a partial kinetic resolution of (S)-lavandulol and preparation of optically enriched (R)-lavandulyl acetate.
PubMed: The biosynthetic origin of irregular monoterpenes in Lavandula: isolation and biochemical characterization of a novel cis-prenyl diphosphate synthase gene, lavandulyl diphosphate synthase.
PubMed: Enzymatic resolution and odor description of both enantiomers of lavandulol, a fragrance of lavender oil.
PubMed: Chemical composition and antioxidative activity of Echinophora platyloba DC. essential oil, and its interaction with natural antimicrobials against food-borne pathogens and spoilage organisms.
PubMed: Hydrolysis of beta,gamma-Unsaturated Aldehyde Dimethylhydrazones with Copper Dichloride: A New Synthesis of Lavandulol.
PubMed: Inhibition by TRPA1 agonists of compound action potentials in the frog sciatic nerve.
PubMed: Role of novel terpenes in transcutaneous permeation of valsartan: effectiveness and mechanism of action.
PubMed: Development of an attractant-baited trap for Oxythyrea funesta Poda (Coleoptera: Scarabaeidae, Cetoniinae).
PubMed: Growth-inhibiting effects of Paeonia lactiflora root steam distillate constituents and structurally related compounds on human intestinal bacteria.
PubMed: Antimicrobial Activity and Chemical Composition of Essential Oil From the Seeds of Artemisia aucheri Boiss.
PubMed: Components of male aggregation pheromone of strawberry blossom weevil, Anthonomus rubi herbst. (Coleoptera:Curculionidae).
PubMed: Male behaviors reveal multiple pherotypes within vine mealybug Planococcus ficus (Signoret) (Hemiptera; Pseudococcidae) populations.
PubMed: A DFT analysis of thermal decomposition reactions important to natural products.
PubMed: Analysis of the essential oil from aerial parts of Eupatorium cannabinum subsp. corsicum (L.) by gas chromatography with electron impact and chemical ionization mass spectrometry.
PubMed: [Not Available].
PubMed: Syntheses and odor descriptions of cyclopropanated compounds, part 6: Analogs of aliphatic monoterpene dienols and non-branched alcohols.
PubMed: Development and optimization of methods for using sex pheromone for monitoring the mealybug Planococcus ficus (Homoptera: Pseudococcidae) in California vineyards.
PubMed: The monoterpenes of Artemisia tridentata ssp. vaseyana, Artemisia cana ssp. viscidula and Artemisia tridentata ssp. spiciformis.
PubMed: Deoxyarteannuin B, dihydro-deoxyarteannuin B and trans-5-hydroxy-2-isopropenyl-5-methylhex-3-en-1-ol from Artemisia anuua.
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