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4128-37-4,MFCD00276304
Catalog No.:AA00C7TS

4128-37-4 | 1,3-diisopropylurea

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$6.00   $4.00
- +
250mg
95%
in stock  
$7.00   $5.00
- +
1g
95%
in stock  
$14.00   $10.00
- +
5g
95%
in stock  
$24.00   $17.00
- +
10g
95%
in stock  
$39.00   $27.00
- +
25g
95%
in stock  
$76.00   $54.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00C7TS
Chemical Name:
1,3-diisopropylurea
CAS Number:
4128-37-4
Molecular Formula:
C7H16N2O
Molecular Weight:
144.2147
MDL Number:
MFCD00276304
SMILES:
CC(NC(=O)NC(C)C)C
NSC Number:
112719
Properties
Properties
 
BP:
265℃  
Form:
Solid  
MP:
185-190℃  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
98.2  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:SHELLPLC-US2477872,1943,A

[2]CurrentPatentAssignee:HONEYWELLINTERNATIONALINC-US2673859,1950,A

[1]Curtius[JournalfurpraktischeChemie(Leipzig1954),1930,vol.<2>125,p.185]Boehmer[RecueildesTravauxChimiquesdesPays-Bas,1936,vol.55,p.382]

[2]Brana;Castellano;Donoso;Rodriquez;Yunta[JournalofHeterocyclicChemistry,1990,vol.27,#2,p.397-399]

[3]Suess-Fink,Georg;Herrmann,Gerhard[AngewandteChemie,1986,vol.98,#6,p.568-569]

4128-37-4   
N,N'-Diisopropyl-C-chlor-formamidinium 

[1]Ulrich,H.etal.[JournalofOrganicChemistry,1964,vol.29,p.2401-2404]

[2]Ulrich,H.;Sayigh,A.A.R.[AngewandteChemie,1966,vol.78,p.761-769]

[1]Tian,Fengshou;Chen,Yahong;Wang,Xiaofang;Li,Peng;Lu,Shiwei[JournalofChemistry,2015,vol.2015]

[2]Li,Jiangwei;Tu,Dong-huai;Li,Yani;Wang,Weiqiang;Yu,Qinwei;Yang,Jianming;Lu,Jian[AppliedCatalysisA:General,2018,vol.549,p.112-116]

[3]Shelton,PhillipA.;Zhang,Yue;Nguyen,ThiHoangHa;McElwee-White,Lisa[ChemicalCommunications,2009,#8,p.947-949]

[4]McCusker,JenniferE.;Main,A.Denise;Johnson,KirstenS.;Grasso,CaraA.;McElwee-White,Lisa[JournalofOrganicChemistry,2000,vol.65,#17,p.5216-5222]

[5]Smirnova,EkaterinaS.;MuñozMolina,JoséM.;Johnson,Alice;Bandeira,NunoA.G.;Bo,Carles;Echavarren,AntonioM.[AngewandteChemie-InternationalEdition,2016,vol.55,#26,p.7487-7491][Angew.Chem.,2016,vol.128,#26,p.7613-7617]

[6]Franz,R.A.etal.[JournalofOrganicChemistry,1961,vol.26,p.3306-3308]

[7]Farrell,WesleyS.;Zavalij,PeterY.;Sita,LawrenceR.[AngewandteChemie-InternationalEdition,2015,vol.54,#14,p.4269-4273][Angew.Chem.,2015,vol.127,#14,p.4343-4347,5]

[1]Collingwood,StephenP;Davies,AlanP;Golding,BernardT[TetrahedronLetters,1987,vol.28,#38,p.4445-4448]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:4128-37-4 Molecular Formula|4128-37-4 MDL|4128-37-4 SMILES|4128-37-4 1,3-diisopropylurea
Catalog No.: AA00C7TS
4128-37-4,MFCD00276304
4128-37-4 | 1,3-diisopropylurea
Pack Size： 100mg
Purity： 95%
in stock
$6.00 $4.00
Pack Size： 250mg
Purity： 95%
in stock
$7.00 $5.00
Pack Size： 1g
Purity： 95%
in stock
$14.00 $10.00
Pack Size： 5g
Purity： 95%
in stock
$24.00 $17.00
Pack Size： 10g
Purity： 95%
in stock
$39.00 $27.00
Pack Size： 25g
Purity： 95%
in stock
$76.00 $54.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00C7TS
Chemical Name: 1,3-diisopropylurea
CAS Number: 4128-37-4
Molecular Formula: C7H16N2O
Molecular Weight: 144.2147
MDL Number: MFCD00276304
SMILES: CC(NC(=O)NC(C)C)C
NSC Number: 112719
Properties
BP: 265℃  
Form: Solid  
MP: 185-190℃  
Storage: Keep in dry area;Room Temperature;  
Complexity: 98.2  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Downstream Synthesis Route
67-64-1    57-13-6    4128-37-4 

[1]CurrentPatentAssignee:SHELLPLC-US2477872,1943,A

[2]CurrentPatentAssignee:HONEYWELLINTERNATIONALINC-US2673859,1950,A

1795-48-8    4128-37-4 

[1]Curtius[JournalfurpraktischeChemie(Leipzig1954),1930,vol.<2>125,p.185]Boehmer[RecueildesTravauxChimiquesdesPays-Bas,1936,vol.55,p.382]

[2]Brana;Castellano;Donoso;Rodriquez;Yunta[JournalofHeterocyclicChemistry,1990,vol.27,#2,p.397-399]

[3]Suess-Fink,Georg;Herrmann,Gerhard[AngewandteChemie,1986,vol.98,#6,p.568-569]

4128-37-4   
N,N'-Diisopropyl-C-chlor-formamidinium 

[1]Ulrich,H.etal.[JournalofOrganicChemistry,1964,vol.29,p.2401-2404]

[2]Ulrich,H.;Sayigh,A.A.R.[AngewandteChemie,1966,vol.78,p.761-769]

201230-82-2    75-31-0    4128-37-4 

[1]Tian,Fengshou;Chen,Yahong;Wang,Xiaofang;Li,Peng;Lu,Shiwei[JournalofChemistry,2015,vol.2015]

[2]Li,Jiangwei;Tu,Dong-huai;Li,Yani;Wang,Weiqiang;Yu,Qinwei;Yang,Jianming;Lu,Jian[AppliedCatalysisA:General,2018,vol.549,p.112-116]

[3]Shelton,PhillipA.;Zhang,Yue;Nguyen,ThiHoangHa;McElwee-White,Lisa[ChemicalCommunications,2009,#8,p.947-949]

[4]McCusker,JenniferE.;Main,A.Denise;Johnson,KirstenS.;Grasso,CaraA.;McElwee-White,Lisa[JournalofOrganicChemistry,2000,vol.65,#17,p.5216-5222]

[5]Smirnova,EkaterinaS.;MuñozMolina,JoséM.;Johnson,Alice;Bandeira,NunoA.G.;Bo,Carles;Echavarren,AntonioM.[AngewandteChemie-InternationalEdition,2016,vol.55,#26,p.7487-7491][Angew.Chem.,2016,vol.128,#26,p.7613-7617]

[6]Franz,R.A.etal.[JournalofOrganicChemistry,1961,vol.26,p.3306-3308]

[7]Farrell,WesleyS.;Zavalij,PeterY.;Sita,LawrenceR.[AngewandteChemie-InternationalEdition,2015,vol.54,#14,p.4269-4273][Angew.Chem.,2015,vol.127,#14,p.4343-4347,5]

113282-06-7    4128-37-4    620-05-3 

[1]Collingwood,StephenP;Davies,AlanP;Golding,BernardT[TetrahedronLetters,1987,vol.28,#38,p.4445-4448]

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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Historical Records
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1093128-36-9
1093128-36-9
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