Home Other Building Blocks 3946-32-5
3946-32-5,MFCD00004427
Catalog No.:AA0035JP

3946-32-5 | Suberic acid monomethyl ester

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1g
97%
in stock  
$6.00   $4.00
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5g
97%
in stock  
$9.00   $7.00
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10g
97%
in stock  
$14.00   $10.00
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25g
>97%
in stock  
$28.00   $19.00
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100g
>97%
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$109.00   $76.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0035JP
Chemical Name:
Suberic acid monomethyl ester
CAS Number:
3946-32-5
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
MDL Number:
MFCD00004427
SMILES:
COC(=O)CCCCCCC(=O)O
Properties
Properties
 
BP:
303.9°C at 760 mmHg  
Form:
Liquid  
MP:
17-19 °C(lit.);  
Refractive Index:
n20/D 1.444(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
165  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
8  
XLogP3:
1.8  

Upstream Synthesis Route

[1]JournaloftheChemicalSociety,PerkinTransactions1:OrganicandBio-OrganicChemistry(1972-1999),1993,#15,p.1713-1714

[2]SyntheticCommunications,1995,vol.25,#5,p.739-742

[3]EuropeanJournalofOrganicChemistry,1999,#10,p.2655-2662

[4]BioorganicandMedicinalChemistryLetters,2004,vol.14,#16,p.4253-4256

[5]BioorganicandMedicinalChemistry,2014,vol.22,#21,p.5766-5775

[6]BioorganicandMedicinalChemistry,2015,vol.23,#13,p.3457-3471

[7]BioorganicandMedicinalChemistry,2012,vol.20,#12,p.3865-3872

[8]HelveticaChimicaActa,2005,vol.88,#9,p.2470-2478

[9]HelveticaChimicaActa,1929,vol.12,p.478

[10]TetrahedronAsymmetry,1991,vol.2,#8,p.801-819

[11]Pharmazie,1989,vol.44,#11,p.758-760

[12]BulletinoftheAcademyofSciencesoftheUSSR,DivisionofChemicalScience(EnglishTranslation),1988,vol.37,#7,p.1514

[13]IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1988,#7,p.1696

[1]Patent:WO2014/150384,2014,A1,.Locationinpatent:Paragraph0091;0092;0093

[1]ChemistryofHeterocyclicCompounds,2015,vol.51,#7,p.647-657

[2]Khim.Geterotsikl.Soedin.,2015,vol.51,#7,p.647-657,11

[1]GreenChemistry,2016,vol.18,#21,p.5764-5768

[2]JournaloftheChemicalSociety,1935,p.290,291

[1]HelveticaChimicaActa,2005,vol.88,#9,p.2470-2478

[2]EuropeanJournalofOrganicChemistry,1999,#10,p.2655-2662

[3]BioorganicandMedicinalChemistry,2015,vol.23,#13,p.3457-3471

[4]ChemistryofHeterocyclicCompounds,2015,vol.51,#7,p.647-657

[5]Khim.Geterotsikl.Soedin.,2015,vol.51,#7,p.647-657,11

Downstream Synthesis Route

[1]GreenChemistry,2016,vol.18,p.5764-5768

[2]JournaloftheChemicalSociety,1935,p.290,291

[1]JournaloftheChemicalSociety,1958,p.4435,4443

[1]HelveticaChimicaActa,1929,vol.12,p.478

[1]JournaloftheChemicalSociety.PerkintransactionsI,1993,p.1713-1714

[2]SyntheticCommunications,1995,vol.25,p.739-742

[3]EuropeanJournalofOrganicChemistry,1999,p.2655-2662

[4]BioorganicandMedicinalChemistryLetters,2004,vol.14,p.4253-4256

[5]BioorganicandMedicinalChemistry,2014,vol.22,p.5766-5775

[6]BioorganicandMedicinalChemistry,2015,vol.23,p.3457-3471

[7]BioorganicandMedicinalChemistry,2012,vol.20,p.3865-3872

[8]HelveticaChimicaActa,2005,vol.88,p.2470-2478

[9]HelveticaChimicaActa,1929,vol.12,p.478

[10]TetrahedronAsymmetry,1991,vol.2,p.801-819

[11]Pharmazie,1989,vol.44,p.758-760

[12]BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1988,vol.37,p.1514    IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1988,p.1696

[1]Locationinpatent:schemeortableHe,Bai;Velaparthi,Subash;Pieffet,Gilles;Pennington,Chris;Mahesh,Aruna;Holzle,DeniseL.;Brunsteiner,Michael;VanBreemen,Richard;Blond,SylvieY.;Petukhov,PavelA.[JournalofMedicinalChemistry,2009,vol.52,#22,p.7003-7013]

[2]Kozikowski,AlanP.;Chen,Yufeng;Gaysin,Arsen;Chen,Bin;D'Annibale,MelissaA.;Suto,CarlaM.;Langley,BrettC.[JournalofMedicinalChemistry,2007,vol.50,#13,p.3054-3061]

[3]CurrentPatentAssignee:UNIVERSITYOFILLINOIS(SYSTEM)-WO2008/19025,2008,A2Locationinpatent:Page/Pagecolumn98;4/22

[4]Chen,Yufeng;Lopez-Sanchez,Miriam;Savoy,DorisN.;Billadeau,DanielD.;Dow,GeoffreyS.;Kozikowski,AlanP.[JournalofMedicinalChemistry,2008,vol.51,#12,p.3437-3448]

Literature
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SDS
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