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938181-32-9,MFCD22544171
Catalog No.:AA003A7E

938181-32-9 | Ethyl 5-oxooxepane-4-carboxylate

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100mg
95%
in stock  
$152.00   $107.00
- +
250mg
95%
in stock  
$260.00   $182.00
- +
500mg
95%
in stock  
$365.00   $256.00
- +
1g
95%
in stock  
$536.00   $376.00
- +
2g
95%
in stock  
$935.00   $655.00
- +
5g
95%
in stock  
$1,899.00   $1,329.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003A7E
Chemical Name:
Ethyl 5-oxooxepane-4-carboxylate
CAS Number:
938181-32-9
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
MDL Number:
MFCD22544171
SMILES:
CCOC(=O)C1CCOCCC1=O
Properties
Computed Properties
 
Complexity:
200  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.4  

Downstream Synthesis Route

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG;NIBR(in:Novartis)-WO2017/103824,2017,A1Locationinpatent:Page/Pagecolumn109

[2]Song,Song;Zhu,Shou-Fei;Pu,Liu-Yang;Zhou,Qi-Lin[AngewandteChemie-InternationalEdition,2013,vol.52,#23,p.6072-6075][Angew.Chem.,2013,vol.125,#23,p.6188-6191]

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2007/62370,2007,A2Locationinpatent:Page/Pagecolumn163

[4]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2018/192864,2018,A1Locationinpatent:Page/Pagecolumn143

[5]CurrentPatentAssignee:ANRUIBIOMEDICALTECHGUANGZHOU-WO2022/111621,2022,A1Locationinpatent:Paragraph0269

[6]CurrentPatentAssignee:ANRUIBIOMEDICALTECHGUANGZHOU-WO2022/111621,2022,A1Locationinpatent:Paragraph0269

[7]CurrentPatentAssignee:JOHNSON&JOHNSONINC-WO2019/171278,2019,A1Locationinpatent:Page/Pagecolumn62-63

938181-32-9   
ethyl5-hydroxyoxepane-4-carboxylate 

[1]CurrentPatentAssignee:ANRUIBIOMEDICALTECHGUANGZHOU-WO2022/111621,2022,A1Locationinpatent:Paragraph0270

[2]CurrentPatentAssignee:ANRUIBIOMEDICALTECHGUANGZHOU-WO2022/111621,2022,A1Locationinpatent:Paragraph0270

[3]Song,Song;Zhu,Shou-Fei;Pu,Liu-Yang;Zhou,Qi-Lin[AngewandteChemie-InternationalEdition,2013,vol.52,#23,p.6072-6075][Angew.Chem.,2013,vol.125,#23,p.6188-6191]

938181-32-9   
ethyl5-((methylsulfonyl)oxy)oxepane-4-carboxylate 

[1]Song,Song;Zhu,Shou-Fei;Pu,Liu-Yang;Zhou,Qi-Lin[AngewandteChemie-InternationalEdition,2013,vol.52,#23,p.6072-6075][Angew.Chem.,2013,vol.125,#23,p.6188-6191]

[2]CurrentPatentAssignee:ANRUIBIOMEDICALTECHGUANGZHOU-WO2022/111621,2022,A1

938181-32-9   
2,3,6,7-tetrahydrooxepine-4-carboxylicacid 

[1]Song,Song;Zhu,Shou-Fei;Pu,Liu-Yang;Zhou,Qi-Lin[AngewandteChemie-InternationalEdition,2013,vol.52,#23,p.6072-6075][Angew.Chem.,2013,vol.125,#23,p.6188-6191]

[1]Song,Song;Zhu,Shou-Fei;Pu,Liu-Yang;Zhou,Qi-Lin[AngewandteChemie-InternationalEdition,2013,vol.52,#23,p.6072-6075][Angew.Chem.,2013,vol.125,#23,p.6188-6191]

[2]CurrentPatentAssignee:ANRUIBIOMEDICALTECHGUANGZHOU-WO2022/111621,2022,A1

Literature
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SDS
Tags:938181-32-9 Molecular Formula|938181-32-9 MDL|938181-32-9 SMILES|938181-32-9 Ethyl 5-oxooxepane-4-carboxylate