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204254-96-6,MFCD08063944
Catalog No.:AA0029AG

204254-96-6 | Ethyl (1S,5R,6S)-5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$14.00   $10.00
- +
5g
95%
in stock  
$31.00   $22.00
- +
25g
98%
in stock  
$148.00   $103.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0029AG
Chemical Name:
Ethyl (1S,5R,6S)-5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate
CAS Number:
204254-96-6
Molecular Formula:
C14H22O4
Molecular Weight:
254.3221
MDL Number:
MFCD08063944
SMILES:
CCOC(=O)C1=C[C@H]([C@@H]2[C@H](C1)O2)OC(CC)CC
Properties
Properties
 
BP:
336.5±42.0°C at 760 mmHg  
Form:
Solid  
MP:
56-57 °C  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
333  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
7  
XLogP3:
2.4  

Downstream Synthesis Route

[1]Rohloff,JohnC.;Kent,KennethM.;Postich,MichaelJ.;Becker,MarkW.;Chapman,HarlanH.;Kelly,DaphneE.;Lew,Willard;Louie,MichaelS.;McGee,LawrenceR.;Prisbe,ErnestJ.;Schultze,LisaM.;Yu,RichardH.;Zhang,Lijun[JournalofOrganicChemistry,1998,vol.63,#13,p.4545-4547]

[2]Kongkamnerd,Jarinrat;Cappelletti,Luca;Prandi,Adolfo;Seneci,Pierfausto;Rungrotmongkol,Thanyada;Jongaroonngamsang,Nutthapon;Rojsitthisak,Pornchai;Frecer,Vladimir;Milani,Adelaide;Cattoli,Giovanni;Terregino,Calogero;Capua,Ilaria;Beneduce,Luca;Gallotta,Andrea;Pengo,Paolo;Fassina,Giorgio;Miertus,Stanislav;De-Eknamkul,Wanchai[BioorganicandMedicinalChemistry,2012,vol.20,#6,p.2152-2157]

[3]CurrentPatentAssignee:TOHOUNIVERSITY-US2014/51756,2014,A1Locationinpatent:Paragraph0098;0099

[4]Ponduri,Rajasekhar;Kumar,Pramod;Vadali,LakshmanaRao;Aelugu,Komaraiah;Matcha,Kishore[AsianJournalofChemistry,2018,vol.30,#9,p.2003-2007]

[5]CurrentPatentAssignee:UNIVZHEJIANGTECHNOLOGY-CN114539088,2022,A

204254-96-6    204255-00-5   
ethyl-(3R,4S,5R)-5-azido-4-hydroxy-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylate 

[1]Rohloff,JohnC.;Kent,KennethM.;Postich,MichaelJ.;Becker,MarkW.;Chapman,HarlanH.;Kelly,DaphneE.;Lew,Willard;Louie,MichaelS.;McGee,LawrenceR.;Prisbe,ErnestJ.;Schultze,LisaM.;Yu,RichardH.;Zhang,Lijun[JournalofOrganicChemistry,1998,vol.63,#13,p.4545-4547]

[2]CurrentPatentAssignee:TOHOUNIVERSITY-US2014/51756,2014,A1Locationinpatent:Paragraph0098

[1]Rohloff,JohnC.;Kent,KennethM.;Postich,MichaelJ.;Becker,MarkW.;Chapman,HarlanH.;Kelly,DaphneE.;Lew,Willard;Louie,MichaelS.;McGee,LawrenceR.;Prisbe,ErnestJ.;Schultze,LisaM.;Yu,RichardH.;Zhang,Lijun[JournalofOrganicChemistry,1998,vol.63,#13,p.4545-4547]

[2]CurrentPatentAssignee:TOHOUNIVERSITY-US2014/51756,2014,A1Locationinpatent:Paragraph0096;0097

[1]Karpf;Trussardi[JournalofOrganicChemistry,2001,vol.66,#6,p.2044-2051]

107-11-9    204254-96-6    312904-12-4   
ethyl(3R,4S,5R)-3-(1-ethylpropoxy)-4-hydroxy-5-N-propylamino-1-cyclohexene-1-carboxylate 

[1]Karpf;Trussardi[JournalofOrganicChemistry,2001,vol.66,#6,p.2044-2051]

Literature
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SDS
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Tags:204254-96-6 Molecular Formula|204254-96-6 MDL|204254-96-6 SMILES|204254-96-6 Ethyl (1S,5R,6S)-5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate