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534-13-4,MFCD00004923
Catalog No.:AA00DE44

534-13-4 | N,N'-DIMETHYLTHIOUREA

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$17.00   $12.00
- +
25g
98%
in stock  
$29.00   $20.00
- +
100g
98%
in stock  
$112.00   $79.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DE44
Chemical Name:
N,N'-DIMETHYLTHIOUREA
CAS Number:
534-13-4
Molecular Formula:
C3H8N2S
Molecular Weight:
104.1740
MDL Number:
MFCD00004923
SMILES:
CNC(=S)NC
NSC Number:
8727
Properties
Computed Properties
 
Complexity:
46.8  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-0.2  

Downstream Synthesis Route

[1]Kaupp,Gerd;Schmeyers,Jens;Boy,Juergen[Tetrahedron,2000,vol.56,#36,p.6899-6911]

[2]Andreasch[MonatsheftefurChemie,1881,vol.2,p.277]

[3]CurrentPatentAssignee:BASFSE-WO2014/26928,2014,A1Locationinpatent:Page/Pagecolumn43

[4]CurrentPatentAssignee:BASFSE-WO2014/26845,2014,A1Locationinpatent:Page/Pagecolumn34

[1]JournaloftheChemicalSociety,1964,p.3478-3480

[1]Locationinpatent:experimentalpartYavari,Issa;Nematpour,Manijeh;Hossaini,Zinatossadat[MonatsheftefurChemie,2010,vol.141,#2,p.229-232]

[2]Lown,J.W.;Ma,J.C.N.[CanadianJournalofChemistry,1967,vol.45,p.939-951]

[1]Lown,J.William;Chauhan,ShiveM.S.[JournalofOrganicChemistry,1983,vol.48,#4,p.507-512]

[2]CurrentPatentAssignee:IMMUNESENSORLLC;THEUNIVERSITYOFTEXASSYSTEM-WO2017/176812,2017,A1Locationinpatent:Paragraph0515

[3]JOHNSTON;MCCALEB;MONTGOMERY[Journalofmedicinalchemistry,1963,vol.6,p.669-681]

[4]Lown;Chauhan[JournalofOrganicChemistry,1983,vol.48,#22,p.3901-3908]

[5]Isobe,Masayoshi[BulletinoftheChemicalSocietyofJapan,1985,vol.58,#10,p.2844-2848]

[6]Lown,J.William;Chauhan,ShiveM.S.[JournaloftheChemicalSociety.Chemicalcommunications,1981,#14,p.675-676]

22536-63-6    534-13-4   
2-<(methylamino)(methylimino)methylthio>-4-methoxypyrimidine 

[1]JournaloftheChemicalSociety.PerkintransactionsII,1989,p.1499-1506

Literature

Title: Yoshiji Ohta, et al. Protective effect of N,N'-dimethylthiourea against stress-induced gastric mucosal lesions in rats. Fundam Clin Pharmacol. 2017 Jun;31(3):319-328.

Title: Zhongyi Zhang, et al. Analysis of volatile compounds in fermented black garlic by GC-MS.

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SDS
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Tags:534-13-4 Molecular Formula|534-13-4 MDL|534-13-4 SMILES|534-13-4 N,N'-DIMETHYLTHIOUREA
Catalog No.: AA00DE44
534-13-4,MFCD00004923
534-13-4 | N,N'-DIMETHYLTHIOUREA
Pack Size： 5g
Purity： 98%
in stock
$17.00 $12.00
Pack Size： 25g
Purity： 98%
in stock
$29.00 $20.00
Pack Size： 100g
Purity： 98%
in stock
$112.00 $79.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DE44
Chemical Name: N,N'-DIMETHYLTHIOUREA
CAS Number: 534-13-4
Molecular Formula: C3H8N2S
Molecular Weight: 104.1740
MDL Number: MFCD00004923
SMILES: CNC(=S)NC
NSC Number: 8727
Properties
Complexity: 46.8  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 6  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -0.2  
Downstream Synthesis Route
556-61-6    74-89-5    534-13-4 

[1]Kaupp,Gerd;Schmeyers,Jens;Boy,Juergen[Tetrahedron,2000,vol.56,#36,p.6899-6911]

[2]Andreasch[MonatsheftefurChemie,1881,vol.2,p.277]

[3]CurrentPatentAssignee:BASFSE-WO2014/26928,2014,A1Locationinpatent:Page/Pagecolumn43

[4]CurrentPatentAssignee:BASFSE-WO2014/26845,2014,A1Locationinpatent:Page/Pagecolumn34

4755-72-0    534-13-4    1762-59-0 

[1]JournaloftheChemicalSociety,1964,p.3478-3480

534-13-4    762-42-5    16238-35-0 

[1]Locationinpatent:experimentalpartYavari,Issa;Nematpour,Manijeh;Hossaini,Zinatossadat[MonatsheftefurChemie,2010,vol.141,#2,p.229-232]

[2]Lown,J.W.;Ma,J.C.N.[CanadianJournalofChemistry,1967,vol.45,p.939-951]

534-13-4    79645-01-5 

[1]Lown,J.William;Chauhan,ShiveM.S.[JournalofOrganicChemistry,1983,vol.48,#4,p.507-512]

[2]CurrentPatentAssignee:IMMUNESENSORLLC;THEUNIVERSITYOFTEXASSYSTEM-WO2017/176812,2017,A1Locationinpatent:Paragraph0515

[3]JOHNSTON;MCCALEB;MONTGOMERY[Journalofmedicinalchemistry,1963,vol.6,p.669-681]

[4]Lown;Chauhan[JournalofOrganicChemistry,1983,vol.48,#22,p.3901-3908]

[5]Isobe,Masayoshi[BulletinoftheChemicalSocietyofJapan,1985,vol.58,#10,p.2844-2848]

[6]Lown,J.William;Chauhan,ShiveM.S.[JournaloftheChemicalSociety.Chemicalcommunications,1981,#14,p.675-676]

22536-63-6    534-13-4   
2-<(methylamino)(methylimino)methylthio>-4-methoxypyrimidine 

[1]JournaloftheChemicalSociety.PerkintransactionsII,1989,p.1499-1506

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