Name: Name:Acetic acid, (carboxymethoxy)-, 1-(1,1-dimethylethyl) ester
Brand: AABLOCKS
SKU: AA00813B
Rating: 90 (10 reviews)

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

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

2033-24-1

120289-22-7

120289-23-8

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

120289-21-6

120289-22-7

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

4480-83-5

75-65-0

120289-22-7

[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]

120289-22-7

685544-34-7

685544-40-5

[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]

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