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150-84-5,MFCD00015039
Catalog No.:AA001M57

150-84-5 | Citronellyl acetate

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25g
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001M57
Chemical Name:
Citronellyl acetate
CAS Number:
150-84-5
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
MDL Number:
MFCD00015039
SMILES:
CC(CCC=C(C)C)CCOC(=O)C
NSC Number:
4893
FEMA Number:
2311
Properties
Properties
 
BP:
258.5°C at 760 mmHg  
Form:
Liquid  
MP:
17.88℃ (estimate)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
191  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.8  

Downstream Synthesis Route
150-84-5   
(+/-)-6-acetoxy-4-methylhexanoicacid 

[1]Beckwith,A.L.J.etal.[AustralianJournalofChemistry,1977,vol.30,p.2177-2188]

[2]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2021/225968,2021,A1

[1]Huang,Yangen;Meng,Wei-Dong;Qing,Feng-Ling[TetrahedronLetters,2004,vol.45,#9,p.1965-1968]

[2]Shing,TonyK.M.;Tai,VincentW.-F.;Tam,EricK.W.[AngewandteChemie,1994,vol.106,#22,p.2408-2409]

[3]Shing,TonyK.M.;Tam,EricK.W.;Tai,VincentW.-F.;Chung,IvanH.F.;Jiang,Qin[Chemistry-AEuropeanJournal,1996,vol.2,#1,p.50-57]

[4]Akashi,K.etal.[JournalofOrganicChemistry,1978,vol.43,#10,p.2063-2066]

[1]Chidambaram,Nallaperumal;Chandrasekaran,Srinivasan[JournalofOrganicChemistry,1987,vol.52,#22,p.5048-5051]

[2]Patel,J.S.etal.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1978,vol.16,p.188-190]

[1]Snider,B.B.;Rodini,D.[TetrahedronLetters,1978,p.1399-1400]

150-84-5    922-67-8   
(E)-9-Acetoxy-4-isopropenyl-7-methyl-non-2-enoicacidmethylester 

[1]Snider,B.B.etal.[JournaloftheAmericanChemicalSociety,1979,vol.101,p.5283-5293]

Literature

Title: TRP and ASIC channels mediate the antinociceptive effect of citronellyl acetate.

Journal: Chemico-biological interactions 20130525

Title: Toxicity of Zanthoxylum piperitum and Zanthoxylum armatum oil constituents and related compounds to Stomoxys calcitrans (Diptera: Muscidae).

Journal: Journal of medical entomology 20120901

Title: Immunotoxicity activity from the essential oils of coriander (Coriandrum sativum) seeds.

Journal: Immunopharmacology and immunotoxicology 20120601

Title: Poisson parameters of antimicrobial activity: a quantitative structure-activity approach.

Journal: International journal of molecular sciences 20120101

Title: Fumigant toxicity of lemon eucalyptus oil constituents to acaricide-susceptible and acaricide-resistant Tetranychus urticae.

Journal: Pest management science 20111201

Title: Improved activity and stability of Rhizopus oryzae lipase via immobilization for citronellol ester synthesis in supercritical carbon dioxide.

Journal: Journal of biotechnology 20111020

Title: Volatile constituents of Zosimia radians Boiss. and Hohen from Iran.

Journal: Natural product research 20110601

Title: Anointing chemicals and hematophagous arthropods: responses by ticks and mosquitoes to citrus (Rutaceae) peel exudates and monoterpene components.

Journal: Journal of chemical ecology 20110401

Title: Enzymatic Synthesis of Isopropyl Acetate by Immobilized Bacillus cereus Lipase in Organic Medium.

Journal: Enzyme research 20110101

Title: Comparative analysis of the volatile fraction of fruit juice from different Citrus species.

Journal: PloS one 20110101

Title: Biochemical characterization of AtuD from Pseudomonas aeruginosa, the first member of a new subgroup of acyl-CoA dehydrogenases with specificity for citronellyl-CoA.

Journal: Microbiology (Reading, England) 20080301

Title: Enantioselective transacetylation of (R,S)-beta-citronellol by propanol rinsed immobilized Rhizomucor miehei lipase.

Journal: Chemistry Central journal 20070101

Title: [Extraction and determination of volatile constituents in leaves of Eucalyptus citriodora].

Journal: Se pu = Chinese journal of chromatography 20051101

Title: Influence of the number of repellent-treated and untreated food or water containers on intake by the European starling.

Journal: Appetite 20050801

Title: The essential oils from Zanthoxylum schinifolium pericarp induce apoptosis of HepG2 human hepatoma cells through increased production of reactive oxygen species.

Journal: Biological & pharmaceutical bulletin 20050501

Title: Characteristic odor components of kumquat (Fortunella japonica Swingle) peel oil.

Journal: Journal of agricultural and food chemistry 20050309

Title: Sensory and instrumental evaluation of catnip (Nepeta cataria L.) aroma.

Journal: Journal of agricultural and food chemistry 20030618

Title: Character impact odorants of Citrus Hallabong [(C. unshiu Marcov x C. sinensis Osbeck) x C. reticulata Blanco] cold-pressed peel oil.

Journal: Journal of agricultural and food chemistry 20030423

Title: Volatile ester formation in roses. Identification of an acetyl-coenzyme A. Geraniol/Citronellol acetyltransferase in developing rose petals.

Journal: Plant physiology 20030401

Title: Anticonflict effects of rose oil and identification of its active constituents.

Journal: Life sciences 20021122

Title: Volatile chemicals identified in extracts from newly hybrid citrus, dekopon (Shiranuhi mandarin Suppl. J.).

Journal: Journal of agricultural and food chemistry 20020911

Title: A new double coupling system: synthesis of citronellyl acetate via transacetylation to citronellol from acetyl coenzyme A produced from glucose and free fatty acids.

Journal: Bioscience, biotechnology, and biochemistry 20010801

Title: Rios ER, et al. TRP and ASIC channels mediate the antinociceptive effect of citronellyl acetate. Chem Biol Interact. 2013 May 25;203(3):573-9.

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Tags:150-84-5 Molecular Formula|150-84-5 MDL|150-84-5 SMILES|150-84-5 Citronellyl acetate