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7787-20-4,MFCD00151104
Catalog No.:AA003B8T

7787-20-4 | (-)-FENCHONE

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Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$29.00   $20.00
- +
25g
98%
in stock  
$54.00   $38.00
- +
100g
98%
in stock  
$145.00   $102.00
- +
500g
98%
in stock  
$544.00   $381.00
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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:
AA003B8T
Chemical Name:
(-)-FENCHONE
CAS Number:
7787-20-4
Molecular Formula:
C10H16O
Molecular Weight:
152.2334
MDL Number:
MFCD00151104
SMILES:
O=C1[C@]2(C)CC[C@H](C1(C)C)C2
FEMA Number:
4519
Properties
Properties
 
BP:
192-194 °C(lit.)  
Form:
Liquid  
MP:
5-6 °C(lit.)  
Refractive Index:
n20/D 1.461(lit.)  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
217  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
XLogP3:
2.3  

Downstream Synthesis Route

[1]Grabowiecka,Agnieszka;Grela,Ewa;Macegoniuk,Katarzyna;Kozioł,Agata;Lochyński,Stanisław[NaturalProductResearch,2020,vol.34,#8,p.1074-1079]

[2]Neganova,Margarita;Aleksandrova,Yulia;Suslov,Evgenii;Mozhaitsev,Evgenii;Munkuev,Aldar;Tsypyshev,Dmitry;Chicheva,Maria;Rogachev,Artem;Sukocheva,Olga;Volcho,Konstantin;Klochkov,Sergey[Pharmaceutics,2021,vol.13,#11]

[3]Pelegri,AdelaSanchez;Elsegood,MarkR.J.;McKee,Vickie;Weaver,GeorgeW.[OrganicLetters,2006,vol.8,#14,p.3049-3051]

[4]CurrentPatentAssignee:WILLIAMMARSHRICEUNIVERSITY-US2018/57444,2018,A1Locationinpatent:Paragraph0098;0110;0111;0112

[5]BulmanPage;Murrell;Limousin;Laffan;Bethell;Slawin;Smith[JournalofOrganicChemistry,2000,vol.65,#13,p.4204-4207]

[6]Dickmu,GerardC.;Smoliakova,IrinaP.[JournalofOrganometallicChemistry,2014,vol.772,p.42-48]

[7]Schmidt;Schulz[BerichtvonSchimmelandCo.,1935,p.97]

[8]Yang,Qi-Liang;Li,Yi-Qian;Ma,Cong;Fang,Ping;Zhang,Xiu-Jie;Mei,Tian-Sheng[JournaloftheAmericanChemicalSociety,2017,vol.139,#8,p.3293-3298]

[9]Agafonov,AlexanderP.;Bormotov,NikolayI.;Korchagina,DinaV.;Maksyutov,RinatA.;Mozhaytsev,EvgeniiS.;Salakhutdinov,NarimanF.;Serova,OlgaA.;Shishkina,LarisaN.;Suslov,EvgeniiV.;Volcho,KonstantinP.;Yarovaya,OlgaI.[RSCMedicinalChemistry,2020,vol.11,#10,p.1185-1195]

[1]Gosselin;Joulain;Laurin;Rouessac[TetrahedronLetters,1990,vol.31,#22,p.3151-3154]

[2]Dimitrov,Vladimir;Bratovanov,Svetoslav;Simova,Svetlana;Kostova,Kalina[TetrahedronLetters,1994,vol.35,#36,p.6713-6716]

[3]Dimitrov,Vladimir;Kostova,Kalina;Genov,Miroslav[TetrahedronLetters,1996,vol.37,#37,p.6787-6790]

358-23-6    7787-20-4   
CASUnavailable 

[1]GarciaMartinez;TesoVilar;OsioBarcina;RodriguezHerrero;DeLaMoyaCerero;Hanack;Subramanian[TetrahedronAsymmetry,1993,vol.4,#11,p.2333-2334]

[2]Martinez;Vilar;Fraile;DelaMoyaCerero;Subramanian[TetrahedronAsymmetry,1994,vol.5,#7,p.1373-1376]

[3]Martinez,A.Garcia;Vilar,E.Teso;Fraile,A.Garcia;DeLaMoyaCerero;Ruiz,P.Martinez;Subramanian[TetrahedronAsymmetry,1996,vol.7,#5,p.1257-1260]

[4]Martinez,A.Garcia;TesoVilar;GarciaFraile;DeLaMoyaCerero;MartinezRuiz;Subramanian[TetrahedronAsymmetry,1996,vol.7,#8,p.2177-2180]

[5]Martinez,AntonioGarcia;Vilar,EnriqueTeso;Fraile,AmeliaGarcia;Cerero,SantiagodelaMoya;Maroto,BeatrizLora[TetrahedronAsymmetry,2001,vol.12,#24,p.3325-3328]

[6]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2016/177710,2016,A1Locationinpatent:Page/Pagecolumn41;42

[1]Locationinpatent:experimentalpartHayashi,Masaki;Sasano,Yusuke;Nagasawa,Shota;Shibuya,Masatoshi;Iwabuchi,Yoshiharu[ChemicalandPharmaceuticalBulletin,2011,vol.59,#12,p.1570-1573]

[2]Dräger,Gerald;Kösel,Teresa;Kirschning,Andreas;Schulz,Göran[AngewandteChemie-InternationalEdition,2020,vol.59,#30,p.12376-12380][Angew.Chem.,2020,vol.132,#30,p.12475-12479,5]

[3]Frigerio,Marco;Santagostino,Marco[TetrahedronLetters,1994,vol.35,#43,p.8019-8022]

[4]Delaude,Lionel;Laszlo,Pierre[JournalofOrganicChemistry,1996,vol.61,#18,p.6360-6370]

[5]Karlsson,Ulrika;Wang,Guo-Zhi;Baeckvall,Jan-E.[JournalofOrganicChemistry,1994,vol.59,#5,p.1196-1198]

[6]DeLuca,Lidia;Giacomelli,Giampaolo;Porcheddu,Andrea[OrganicLetters,2001,vol.3,#19,p.3041-3043]

[7]Pingen,Dennis;Diebolt,Olivier;Vogt,Dieter[ChemCatChem,2013,vol.5,#10,p.2905-2912]

[8]Chánique,AndreaM.;Dimos,Nicole;Drienovská,Ivana;Calderini,Elia;Pantín,MónicaP.;Helmer,CarlP.O.;Hofer,Michael;Sieber,Volker;Parra,LoretoP.;Loll,Bernhard;Kourist,Robert[ChemCatChem,2021,vol.13,#9,p.2262-2277]

[9]Schulz,Göran;George,Vincent;Taser,Daghan;Kirschning,Andreas[JournalofOrganicChemistry,2023,vol.88,#6,p.3781-3786]

7787-20-4    2733493-76-8   
CASUnavailable 

[1]Dimitrov,Vladimir;Bratovanov,Svetoslav;Simova,Svetlana;Kostova,Kalina[TetrahedronLetters,1994,vol.35,#36,p.6713-6716]

[2]Dimitrov,Vladimir;Kostova,Kalina;Genov,Miroslav[TetrahedronLetters,1996,vol.37,#37,p.6787-6790]

[3]Genov,Miroslav;Kostova,Kalina;Dimitrov,Vladimir[TetrahedronAsymmetry,1997,vol.8,#11,p.1869-1876]

Literature

Title: Miyazawa M, et al. Metabolism of (-)-fenchone by CYP2A6 and CYP2B6 in human liver microsomes. Xenobiotica. 2007;37(2):194-204.

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SDS
Tags:7787-20-4 Molecular Formula|7787-20-4 MDL|7787-20-4 SMILES|7787-20-4 (-)-FENCHONE