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183616-18-4,MFCD11100969
Catalog No.:AA0027OX

183616-18-4 | 3-(Hydroxymethyl)cyclobutanone

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1g
≥95%
in stock  
$56.00   $39.00
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5g
≥95%
in stock  
$223.00   $156.00
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25g
≥95%
in stock  
$900.00   $630.00
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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:
AA0027OX
Chemical Name:
3-(Hydroxymethyl)cyclobutanone
CAS Number:
183616-18-4
Molecular Formula:
C5H8O2
Molecular Weight:
100.1158
MDL Number:
MFCD11100969
SMILES:
OCC1CC(=O)C1
Properties
Computed Properties
 
Complexity:
80.1  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
-0.7  

Downstream Synthesis Route

[1]Lopp,Margus;Paju,Anne;Kanger,Tonis;Pehk,Tonis[TetrahedronLetters,1996,vol.37,#42,p.7583-7586]

183616-18-4   
3-fluoromethylcyclobutanone 

[1]Ghazi,Hedieh;Lee-Ruff,Edward[JournalofFluorineChemistry,2005,vol.126,#11-12,p.1565-1569]

[1]CurrentPatentAssignee:EMORYUNIVERSITY-WO2006/63281,2006,A2Locationinpatent:Page/Pagecolumn75-76

[2]Kuethe,JeffreyT.;Basu,Kallol;Orr,RobertK.;Ashley,Eric;Poirier,Marc;Tan,Lushi[BioorganicandMedicinalChemistry,2018,vol.26,#4,p.938-944]

[1]CurrentPatentAssignee:EMORYUNIVERSITY-WO2006/63281,2006,A2Locationinpatent:Page/Pagecolumn75

[2]CurrentPatentAssignee:ACHAOGENINC-WO2013/170030,2013,A1

[3]CurrentPatentAssignee:PHARMASCIENCEINC-WO2015/74135,2015,A1Locationinpatent:Page/Pagecolumn50;51

[1]CurrentPatentAssignee:EISAICOLTD-US2011/86882,2011,A1Locationinpatent:Page/Pagecolumn24

Literature
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SDS
Tags:183616-18-4 Molecular Formula|183616-18-4 MDL|183616-18-4 SMILES|183616-18-4 3-(Hydroxymethyl)cyclobutanone