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120289-22-7,MFCD20640417
Catalog No.:AA00813B

120289-22-7 | Acetic acid, (carboxymethoxy)-, 1-(1,1-dimethylethyl) ester

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Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$115.00   $81.00
- +
1g
95%
in stock  
$286.00   $200.00
- +
5g
95%
in stock  
$945.00   $662.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00813B
Chemical Name:
Acetic acid, (carboxymethoxy)-, 1-(1,1-dimethylethyl) ester
CAS Number:
120289-22-7
Molecular Formula:
C8H14O5
Molecular Weight:
190.1938
MDL Number:
MFCD20640417
SMILES:
O=C(OC(C)(C)C)COCC(=O)O
Properties
Computed Properties
 
Complexity:
191  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
6  
XLogP3:
0.6  

Downstream Synthesis Route

[1]Beresford;Macrae;Alker;Kobylecki[Arzneimittel-Forschung/DrugResearch,1989,vol.39,#2,p.201-209]

[1]Beresford;Macrae;Alker;Kobylecki[Arzneimittel-Forschung/DrugResearch,1989,vol.39,#2,p.201-209]

[1]Sahu,Swagatika;Sinha,Niharika;Bhutia,SujitK.;Majhi,Megharay;Mohapatra,Sasmita[JournalofMaterialsChemistryB,2014,vol.2,#24,p.3799-3808]

[2]Greenwald,RichardB.;Pendri,Annapurna;Conover,CharlesD.;Lee,Chyi;Choe,YunH.;Gilbert,Carl;Martinez,Anthony;Xia,Jing;Wu,Dechun;Hsue,Mei-mann[BioorganicandMedicinalChemistry,1998,vol.6,#5,p.551-562]

[3]CurrentPatentAssignee:MERCK&COINC;PISSARNITSKIDMITRIA-WO2022/46747,2022,A1Locationinpatent:Page/Pagecolumn48;49

[4]CurrentPatentAssignee:MERCK&COINC;PISSARNITSKIDMITRIA-WO2022/46747,2022,A1Locationinpatent:Page/Pagecolumn48;49

7689-03-4    120289-22-7   
tert-Butoxycarbonylmethoxy-aceticacid(S)-4-ethyl-3,13-dioxo-3,4,12,13-tetrahydro-1H-2-oxa-6,12a-diaza-dibenzob,hfluoren-4-ylester 

[1]Sahu,Swagatika;Sinha,Niharika;Bhutia,SujitK.;Majhi,Megharay;Mohapatra,Sasmita[JournalofMaterialsChemistryB,2014,vol.2,#24,p.3799-3808]

[2]Greenwald,RichardB.;Pendri,Annapurna;Conover,CharlesD.;Lee,Chyi;Choe,YunH.;Gilbert,Carl;Martinez,Anthony;Xia,Jing;Wu,Dechun;Hsue,Mei-mann[BioorganicandMedicinalChemistry,1998,vol.6,#5,p.551-562]

[1]Mehrotra,MukundM.;Heath,JulieA.;Smyth,MarkS.;Pandey,Anjali;Rose,JackW.;Seroogy,JosephM.;Volkots,DeborahL.;Nannizzi-Alaimo,Lisa;Park,GaryL.;Lambing,JosephL.;Hollenbach,StanleyJ.;Scarborough,RobertM.[JournalofMedicinalChemistry,2004,vol.47,#8,p.2037-2061]

Literature
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SDS
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Tags:120289-22-7 Molecular Formula|120289-22-7 MDL|120289-22-7 SMILES|120289-22-7 Acetic acid, (carboxymethoxy)-, 1-(1,1-dimethylethyl) ester