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13031-76-0,MFCD00154867
Catalog No.:AA000U7K

13031-76-0 | 3-Hydroxytetrahydro-1h-1lambda6-thiophene-1,1-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$16.00   $11.00
- +
1g
98%
in stock  
$33.00   $23.00
- +
5g
96%
in stock  
$143.00   $100.00
- +
10g
96%
in stock  
$245.00   $171.00
- +
25g
98%
in stock  
$440.00   $308.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000U7K
Chemical Name:
3-Hydroxytetrahydro-1h-1lambda6-thiophene-1,1-dione
CAS Number:
13031-76-0
Molecular Formula:
C4H8O3S
Molecular Weight:
136.1695
MDL Number:
MFCD00154867
SMILES:
OC1CCS(=O)(=O)C1
NSC Number:
147314
Properties
Properties
 
BP:
382°C at 760 mmHg  
Form:
Solid  
Storage:
2-8℃;Keep in dry area;  

Computed Properties
 
Complexity:
164  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Undefined Atom Stereocenter Count:
1  
XLogP3:
-0.9  

Downstream Synthesis Route

[1]Martinez,Ramon;Huang,Weiliang;Samadani,Ramin;Mackowiak,Bryan;Centola,Garrick;Chen,Lijia;Conlon,IvieL.;Hom,Kellie;Kane,MaureenA.;Fletcher,Steven;Shapiro,Paul[JournalofPharmacologyandExperimentalTherapeutics,2021,vol.376,#1,p.84-97]

[2]CurrentPatentAssignee:SUMITOMOSEIKACHEMICALSCOMPANYLIMITED-JP5832315,2015,B2Locationinpatent:Paragraph0044

[3]CurrentPatentAssignee:SAMSUNGSDICO.,LTD.-US10320032,2019,B2Locationinpatent:Page/Pagecolumn19

[4]Fujii,Shota;McCarthy,ThomasJ.[Langmuir,2016,vol.32,#3,p.765-771]

[5]vanZuydewijn[RecueildesTravauxChimiquesdesPays-Bas,1937,vol.56,p.1047,1060]Backer;Strating[RecueildesTravauxChimiquesdesPays-Bas,1943,vol.62,p.815,819]

[1]Dodd,JohnH.;Schwender,CharlesF.;Gray-Nunez,Yolanda[JournalofHeterocyclicChemistry,1990,vol.27,#5,p.1453-1456]

[1]ChemistryofHeterocyclicCompounds,1980,vol.16,p.1122-1124    KhimiyaGeterotsiklicheskikhSoedinenii,1980,vol.16,p.1482-1484

[2]ChemistryofHeterocyclicCompounds,1980,vol.16,p.1122-1124    KhimiyaGeterotsiklicheskikhSoedinenii,1980,vol.16,p.1482-1484

[3]ChemistryofHeterocyclicCompounds,1980,vol.16,p.1122-1124    KhimiyaGeterotsiklicheskikhSoedinenii,1980,vol.16,p.1482-1484

[1]Tolstikov,G.A.;Novitskaya,N.N.;Shul'ts,E.E.[JournalofOrganicChemistryUSSR(EnglishTranslation),1982,vol.18,#6,p.1129-1134][ZhurnalOrganicheskoiKhimii,1982,vol.18,#6,p.1301-1306]

[1]Tolstikov,G.A.;Novitskaya,N.N.;Shul'ts,E.E.[JournalofOrganicChemistryUSSR(EnglishTranslation),1982,vol.18,#6,p.1129-1134][ZhurnalOrganicheskoiKhimii,1982,vol.18,#6,p.1301-1306]

Literature

Title: Determination of busulfan in human plasma using an ELISA format.

Journal: Therapeutic drug monitoring 20090801

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SDS
Tags:13031-76-0 Molecular Formula|13031-76-0 MDL|13031-76-0 SMILES|13031-76-0 3-Hydroxytetrahydro-1h-1lambda6-thiophene-1,1-dione