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53732-47-1,MFCD00063006
Catalog No.:AA003CCU

53732-47-1 | (S)-(+)-1,2,3,4-Tetrahydro-1-naphthol

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100mg
98%
in stock  
$13.00   $9.00
- +
500mg
95%
in stock  
$24.00   $17.00
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1g
95%
in stock  
$45.00   $32.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003CCU
Chemical Name:
(S)-(+)-1,2,3,4-Tetrahydro-1-naphthol
CAS Number:
53732-47-1
Molecular Formula:
C10H12O
Molecular Weight:
148.2017
MDL Number:
MFCD00063006
SMILES:
O[C@H]1CCCc2c1cccc2
Properties
Properties
 
BP:
254.8 °C at 760 mmHg  
Form:
Solid  
MP:
37-39 °C  
Refractive Index:
33 ° (C=2.5, CHCl3)  
Storage:
2-8℃;Keep in dry area;  

Computed Properties
 
Complexity:
133  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
XLogP3:
1.8  

Downstream Synthesis Route

[1]Davies;White[JournaloftheChemicalSociety,1952,p.3300,3302]

[2]Gutman,ArieL.;Brenner,Dov;Boltanski,Aviv[TetrahedronAsymmetry,1993,vol.4,#5,p.839-844]Hagiwara,Hisahiro;Nakano,Takashi;Uda,Hisashi[BulletinoftheChemicalSocietyofJapan,1993,vol.66,#10,p.3110-3112]Lin,Gialih;Liu,Hsiao-Chien[TetrahedronLetters,1995,vol.36,#34,p.6067-6068]Naemura;Fukuda;Murata;Konishi;Hirose;Tobe[TetrahedronAsymmetry,1995,vol.6,#9,p.2385-2394]Suginaka,Kaoru;Hayashi,Yoshiyuki;Yamamoto,Yukio[TetrahedronAsymmetry,1996,vol.7,#4,p.1153-1158]

[3]Faller;Lavoie,AdrienR.[OrganicLetters,2001,vol.3,#23,p.3703-3706]

[4]Yamada,Shinji;Katsumata,Hiroko[JournalofOrganicChemistry,1999,vol.64,#26,p.9365-9373]

[5]Noe,ChristianR.;Knollmueller,Max;Wagner,Ernst;Voellenkle,Horst[ChemischeBerichte,1985,vol.118,#5,p.1733-1745]

[6]CurrentPatentAssignee:CHINATHREEGORGESUNIVERSITY-CN110002961,2019,A

[7]Yang,Bing;Cui,Peng;Chen,Yongsheng;Liu,Qixing;Zhou,Haifeng[TetrahedronLetters,2020,vol.61,#46]

[8]Oestreich,Martin;Seliger,Jan[AngewandteChemie-InternationalEdition,2021,vol.60,#1,p.247-251][Angew.Chem.,2021,vol.133,#1,p.251-255,5]

[9]Zhao,Zhitong;Wang,Chengyi;Chen,Qipeng;Wang,Yu;Xiao,Rui;Tan,Chunxia;Liu,Guohua[ChemCatChem,2021,vol.13,#18,p.4055-4063]

[10]Zhu,Chengfeng;Tang,Haitong;Yang,Keke;Fang,Yu;Wang,Kun-Yu;Xiao,Zhifeng;Wu,Xiang;Li,Yougui;Powell,JoshuaA.;Zhou,Hong-Cai[JournaloftheAmericanChemicalSociety,2021,vol.143,#32,p.12560-12566]

[1]Valk,JeanMarc;Whitlock,GavinA.;Layzell,TimothyP.;Brown,JohnM.[TetrahedronAsymmetry,1995,vol.6,#10,p.2593-2596]

[2]Doucet,Henri;Fernandez,Elena;Layzell,TimothyP.;Brown,JohnM.[Chemistry-AEuropeanJournal,1999,vol.5,#4,p.1320-1330]

[3]Connolly,DavidJ.;Lacey,PatrickM.;McCarthy,Mary;Saunders,CormacP.;Carroll,Anne-Marie;Goddard,Richard;Guiry,PatrickJ.[JournalofOrganicChemistry,2004,vol.69,#20,p.6572-6589]

[4]Connolly,DavidJ.;Lacey,PatrickM.;McCarthy,Mary;Saunders,CormacP.;Carroll,Anne-Marie;Goddard,Richard;Guiry,PatrickJ.[JournalofOrganicChemistry,2004,vol.69,#20,p.6572-6589]

[5]McCarthy,Mary;Hooper,MarkW.;Guiry,PatrickJ.[ChemicalCommunications,2000,#14,p.1333-1334]

[6]Locationinpatent:experimentalpartMaxwell,AoifeC.;Flanagan,SusanP.;Goddard,Richard;Guiry,PatrickJ.[TetrahedronAsymmetry,2010,vol.21,#11-12,p.1458-1473]

[7]Locationinpatent:experimentalpartFleming,WilliamJ.;Mueller-Bunz,Helge;Guiry,PatrickJ.[EuropeanJournalofOrganicChemistry,2010,#31,p.5996-6004]

53732-47-1    49623-71-4   
(R)-(+)-(1,2,3,4-tetrahydro-1-naphthyl)2,4,6-triisopropylbenzoate 

[1]Hammerschmidt,Friedrich;Hanninger,Achim;PericSimov,Biljana;Voellenkle,Horst;Werner,Andreas[EuropeanJournalofOrganicChemistry,1999,#12,p.3511-3518]

108-05-4    529-33-9    53732-47-1   
(R)-1,2,3,4-tetrahydronaphthalen-1-ylacetate 

[1]Ferraz,HelenaM.C.;Bianco,GrazielaG.;Teixeira,CarlaC.;Andrade,LeandroH.;Porto,AndreL.M.[TetrahedronAsymmetry,2007,vol.18,#9,p.1070-1076]

[2]Raval,HitenB.;Bedekar,AshutoshV.[NewJournalofChemistry,2020,vol.44,#48,p.21238-21243]

[3]Hoang,HaiNam;Matsuda,Tomoko;Suzuki,Yuichi;Tamura,Mayumi;Taniguchi,Kosuke[TetrahedronLetters,2022,vol.99]

[4]Bakker;Spruijt;VanRantwijk;Sheldon[TetrahedronAsymmetry,2000,vol.11,#8,p.1801-1808]

[5]Matsuda,Tomoko;Watanabe,Kazunori;Harada,Tadao;Nakamura,Kaoru;Arita,Yoshitaka;Misumi,Yukibiro;Ichikawa,Shinichiro;Ikariya,Takao[ChemicalCommunications,2004,#20,p.2286-2287]

[6]More,GaneshV.;Badgujar,KirtikumarC.;Bhanage,BhalchandraM.[RSCAdvances,2015,vol.5,#6,p.4592-4598]

[1]Ferreira;Stoltz[JournaloftheAmericanChemicalSociety,2001,vol.123,#31,p.7725-7726]

[2]Mandal,SunilK.;Jensen,DavidR.;Pugsley,JacobS.;Sigman,MatthewS.[JournalofOrganicChemistry,2003,vol.68,#11,p.4600-4603]

[3]Bagdanoff,JeffreyT;Ferreira,EricM;Stoltz,BrianM[Organicletters,2003,vol.5,#6,p.835-837]

[4]Bagdanoff,JeffreyT.;Stoltz,BrianM.[AngewandteChemie-InternationalEdition,2004,vol.43,#3,p.353-357]

[5]Chen,Tao;Jiang,Jia-Jun;Xu,Qin;Shi,Min[OrganicLetters,2007,vol.9,#5,p.865-868]

[6]Locationinpatent:schemeortableTrend,RaissaM.;Stoltz,BrianM.[JournaloftheAmericanChemicalSociety,2008,vol.130,#47,p.15957-15966]

[7]Ebner,DavidC.;Bagdanoff,JeffreyT.;Ferreira,EricM.;McFadden,RyanM.;Caspi,DanielD.;Trend,RaissaM.;Stoltz,BrianM.[Chemistry-AEuropeanJournal,2009,vol.15,#47,p.12978-12992]

[8]Zhang,Dao;Yu,Jueqin[Organometallics,2020,vol.39,#4,p.605-613]

Literature

Title: Factorizing the role of a critical leucine residue in the binding of substrate to human 20alpha-hydroxysteroid dehydrogenase (AKR1C1): molecular modeling and kinetic studies of the Leu308Val mutant enzyme.

Journal: Bioorganic & medicinal chemistry letters 20100901

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Tags:53732-47-1 Molecular Formula|53732-47-1 MDL|53732-47-1 SMILES|53732-47-1 (S)-(+)-1,2,3,4-Tetrahydro-1-naphthol