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215790-29-7,MFCD03844592
Catalog No.:AA00BD8V

215790-29-7 | tert-Butyl trans-4-(2-oxoethyl)cyclohexylcarbamate

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BD8V
Chemical Name:
tert-Butyl trans-4-(2-oxoethyl)cyclohexylcarbamate
CAS Number:
215790-29-7
Molecular Formula:
C13H23NO3
Molecular Weight:
241.3266
MDL Number:
MFCD03844592
SMILES:
O=CC[C@@H]1CC[C@H](CC1)NC(=O)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
262  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Stemp,Geoffrey;Ashmeade,Tracey;Branch,CliveL.;Hadley,MichaelS.;Hunter,A.Jacqueline;Johnson,ChristopherN.;Nash,DavidJ.;Thewlis,KevinM.;Vong,AntonioK.K.;Austin,NigelE.;Jeffrey,Phillip;Avenell,KimY.;Boyfield,Izzy;Hagan,JimJ.;Middlemiss,DerekN.;Reavill,Charlie;Riley,GrahamJ.;Routledge,Carole;Wood,Martyn[JournalofMedicinalChemistry,2000,vol.43,#9,p.1878-1885]

[1]Shonberg,Jeremy;Herenbrink,CarmenKlein;López,Laura;Christopoulos,Arthur;Scammells,PeterJ.;Capuano,Ben;Lane,J.Robert[JournalofMedicinalChemistry,2013,vol.56,#22,p.9199-9221]

[2]Stemp,Geoffrey;Ashmeade,Tracey;Branch,CliveL.;Hadley,MichaelS.;Hunter,A.Jacqueline;Johnson,ChristopherN.;Nash,DavidJ.;Thewlis,KevinM.;Vong,AntonioK.K.;Austin,NigelE.;Jeffrey,Phillip;Avenell,KimY.;Boyfield,Izzy;Hagan,JimJ.;Middlemiss,DerekN.;Reavill,Charlie;Riley,GrahamJ.;Routledge,Carole;Wood,Martyn[JournalofMedicinalChemistry,2000,vol.43,#9,p.1878-1885]

[3]Shonberg,Jeremy;Draper-Joyce,Christopher;Mistry,ShaileshN.;Christopoulos,Arthur;Scammells,PeterJ.;Lane,J.Robert;Capuano,Ben[JournalofMedicinalChemistry,2015,vol.58,#13,p.5287-5307]

[1]Stemp,Geoffrey;Ashmeade,Tracey;Branch,CliveL.;Hadley,MichaelS.;Hunter,A.Jacqueline;Johnson,ChristopherN.;Nash,DavidJ.;Thewlis,KevinM.;Vong,AntonioK.K.;Austin,NigelE.;Jeffrey,Phillip;Avenell,KimY.;Boyfield,Izzy;Hagan,JimJ.;Middlemiss,DerekN.;Reavill,Charlie;Riley,GrahamJ.;Routledge,Carole;Wood,Martyn[JournalofMedicinalChemistry,2000,vol.43,#9,p.1878-1885]

[1]Austin,NigelE.;Avenell,KimY.;Boyfield,Izzy;Branch,CliveL.;Hadley,MichaelS.;Jeffrey,Phillip;Johnson,ChristopherN.;Macdonald,GregorJ.;Nash,DavidJ.;Riley,GrahamJ.;Smith,AlexanderB.;Stemp,Geoffrey;Thewlis,KevinM.;Vong,AntonioK.K.;Wood,Martyn[BioorganicandMedicinalChemistryLetters,2000,vol.10,#22,p.2553-2555]

[1]Austin,NigelE;Avenell,KimY;Boyfield,Izzy;Branch,CliveL;Hadley,MichaelS;Jeffrey,Phillip;Johnson,ChristopherN;Macdonald,GregorJ;Nash,DavidJ;Riley,GrahamJ;Smith,AlexanderB;Stemp,Geoffrey;Thewlis,KevinM;Vong,AntonioK.K;Wood,MartynD[BioorganicandMedicinalChemistryLetters,2001,vol.11,#5,p.685-688]

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Tags:215790-29-7 Molecular Formula|215790-29-7 MDL|215790-29-7 SMILES|215790-29-7 tert-Butyl trans-4-(2-oxoethyl)cyclohexylcarbamate