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1728-46-7,MFCD00009696
Catalog No.:AA00HZID

1728-46-7 | 2-tert-Butylcyclohexanone

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Purity
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Price(USD)
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1g
95%
in stock  
$45.00   $32.00
- +
5g
95%
in stock  
$112.00   $78.00
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25g
95%
in stock  
$311.00   $218.00
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100g
95%
in stock  
$809.00   $567.00
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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:
AA00HZID
Chemical Name:
2-tert-Butylcyclohexanone
CAS Number:
1728-46-7
Molecular Formula:
C10H18O
Molecular Weight:
154.2493
MDL Number:
MFCD00009696
SMILES:
CC(C)(C)C1CCCCC1=O
Properties
Properties
 
BP:
199.1°C at 760 mmHg  
Form:
Solid  
MP:
38.55°C  
Refractive Index:
n20/D 1.457(lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
153  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.7  

Downstream Synthesis Route

[1]Reetz,ManfredT.;Maier,WilhelmF.;Chatziiosifidis,Ioannis;Giannis,Athanassios;Heimbach,Horst;Loewe,Ursula[ChemischeBerichte,1980,vol.113,#12,p.3741-3757]

[2]Lion,Claude;Dubois,Jacques-Emile[BulletindelaSocieteChimiquedeFrance,1982,vol.2,#11-12,p.375-379]

[3]Walters,JenniferC.;Tierno,AnthonyF.;Dubin,AimeeH.;Wengryniuk,SarahE.[EuropeanJournalofOrganicChemistry,2018,vol.2018,#12,p.1460-1464]

[4]Reetz,ManfredT.;Maier,WilhelmF.;Heimbach,Horst;Giannis,Athanassios;Anastassious,Georgia[ChemischeBerichte,1980,vol.113,#12,p.3734-3740]

[5]Chan,T.H.etal.[TetrahedronLetters,1977,#48,p.4183-4186]

[6]Reetz,ManfredT.;Maier,WilhelmF.;Heimbach,Horst;Giannis,Athanassios;Anastassious,Georgia[ChemischeBerichte,1980,vol.113,#12,p.3734-3740]

[7]Carlson,Rolf;Lundstedt,Torbjoern;Nordahl,Ake;Prochazka,Michal[ActachemicaScandinavica.SeriesB:Organicchemistryandbiochemistry,1986,vol.40,#7,p.522-533]

[8]Basso;Kaiser;Rittner;Lambert[JournalofOrganicChemistry,1993,vol.58,#27,p.7865-7869]

[9]Locationinpatent:experimentalpartSasidharan,Manickam;Bhaumik,Asim[JournalofMolecularCatalysisA:Chemical,2011,vol.346,#1-2,p.87-93]

[10]Lavinda,Olga;Witt,CollinH.;Woerpel,K.A.[AngewandteChemie-InternationalEdition,2022,vol.61,#14][Angew.Chem.,2022,vol.134,#14]

[1]Ito,Satoru;Matsumoto,Masakatsu[JournalofOrganicChemistry,1983,vol.48,#7,p.1133-1135]

[1]House,HerbertO.;Outcalt,RussellJ.;Cliffton,MichaelD.[JournalofOrganicChemistry,1982,vol.47,#12,p.2413-2419]

[2]Reetz,ManfredT.;Maier,WilhelmF.;Heimbach,Horst;Giannis,Athanassios;Anastassious,Georgia[ChemischeBerichte,1980,vol.113,#12,p.3734-3740]

[1]Cren,Sylvaine;Schar,Pascal;Renaud,Philippe;Schenk,Kurt[JournalofOrganicChemistry,2009,vol.74,#8,p.2942-2946]

[2]Pine;Shen;Hoang[Synthesis,1991,#2,p.165-167]

[1]Johnson,CarlR.;Zeller,JamesR.[JournaloftheAmericanChemicalSociety,1982,vol.104,#14,p.4021-4023]

Literature
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SDS
Tags:1728-46-7 Molecular Formula|1728-46-7 MDL|1728-46-7 SMILES|1728-46-7 2-tert-Butylcyclohexanone