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116393-71-6,MFCD12498716
Catalog No.:AA00IWK0

116393-71-6 | Methyl 5-iodo-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$140.00   $98.00
- +
250mg
95%
in stock  
$186.00   $130.00
- +
500mg
95%
in stock  
$310.00   $217.00
- +
1g
95%
in stock  
$463.00   $324.00
- +
5g
95%
in stock  
$1,387.00   $971.00
- +
10g
95%
in stock  
$2,218.00   $1,553.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IWK0
Chemical Name:
Methyl 5-iodo-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate
CAS Number:
116393-71-6
Molecular Formula:
C6H5IN2O4
Molecular Weight:
296.0194
MDL Number:
MFCD12498716
SMILES:
COC(=O)c1[nH]c(=O)[nH]c(=O)c1I
Properties
Computed Properties
 
Complexity:
323  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-0.3  

Downstream Synthesis Route

[1]Patent:US2009/88322,2009,A1.Locationinpatent:Page/Pagecolumn10

[2]BioorganicandMedicinalChemistry,2017,vol.25,p.1465-1470

116393-71-6    42969-65-3   
C10H10N2O5 

[1]PLoSONE,2016,vol.11

143874-13-9    116393-71-6   
C14H8F2N2O4 

[1]Inaoka,DanielKen;Iida,Maiko;Honma,Teruki;Harada,Shigeharu;Nara,Takeshi;Balogun,EmmanuelOluwadare;Kita,Kiyoshi;Hashimoto,Satoshi;Tanaka,Akiko;Kita,Kiyoshi;Tabuchi,Toshiyuki;Kuranaga,Takefumi;Inoue,Masayuki[BioorganicandMedicinalChemistry,2017,vol.25,#4,p.1465-1470]

116393-71-6    705-28-2   
C15H9F3N2O4 

[1]Inaoka,DanielKen;Iida,Maiko;Honma,Teruki;Harada,Shigeharu;Nara,Takeshi;Balogun,EmmanuelOluwadare;Kita,Kiyoshi;Hashimoto,Satoshi;Tanaka,Akiko;Kita,Kiyoshi;Tabuchi,Toshiyuki;Kuranaga,Takefumi;Inoue,Masayuki[BioorganicandMedicinalChemistry,2017,vol.25,#4,p.1465-1470]

116393-71-6    88444-81-9   
C16H8F6N2O4 

[1]BioorganicandMedicinalChemistry,2017,vol.25,p.1465-1470

Literature
Quotation Request
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SDS
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Tags:116393-71-6 Molecular Formula|116393-71-6 MDL|116393-71-6 SMILES|116393-71-6 Methyl 5-iodo-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate
Catalog No.: AA00IWK0
116393-71-6,MFCD12498716
116393-71-6 | Methyl 5-iodo-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate
Pack Size： 100mg
Purity： 95%
in stock
$140.00 $98.00
Pack Size： 250mg
Purity： 95%
in stock
$186.00 $130.00
Pack Size： 500mg
Purity： 95%
in stock
$310.00 $217.00
Pack Size： 1g
Purity： 95%
in stock
$463.00 $324.00
Pack Size： 5g
Purity： 95%
in stock
$1,387.00 $971.00
Pack Size： 10g
Purity： 95%
in stock
$2,218.00 $1,553.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IWK0
Chemical Name: Methyl 5-iodo-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate
CAS Number: 116393-71-6
Molecular Formula: C6H5IN2O4
Molecular Weight: 296.0194
MDL Number: MFCD12498716
SMILES: COC(=O)c1[nH]c(=O)[nH]c(=O)c1I
Properties
Complexity: 323  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -0.3  
Downstream Synthesis Route
6153-44-2    116393-71-6 

[1]Patent:US2009/88322,2009,A1.Locationinpatent:Page/Pagecolumn10

[2]BioorganicandMedicinalChemistry,2017,vol.25,p.1465-1470

116393-71-6    42969-65-3   
C10H10N2O5 

[1]PLoSONE,2016,vol.11

143874-13-9    116393-71-6   
C14H8F2N2O4 

[1]Inaoka,DanielKen;Iida,Maiko;Honma,Teruki;Harada,Shigeharu;Nara,Takeshi;Balogun,EmmanuelOluwadare;Kita,Kiyoshi;Hashimoto,Satoshi;Tanaka,Akiko;Kita,Kiyoshi;Tabuchi,Toshiyuki;Kuranaga,Takefumi;Inoue,Masayuki[BioorganicandMedicinalChemistry,2017,vol.25,#4,p.1465-1470]

116393-71-6    705-28-2   
C15H9F3N2O4 

[1]Inaoka,DanielKen;Iida,Maiko;Honma,Teruki;Harada,Shigeharu;Nara,Takeshi;Balogun,EmmanuelOluwadare;Kita,Kiyoshi;Hashimoto,Satoshi;Tanaka,Akiko;Kita,Kiyoshi;Tabuchi,Toshiyuki;Kuranaga,Takefumi;Inoue,Masayuki[BioorganicandMedicinalChemistry,2017,vol.25,#4,p.1465-1470]

116393-71-6    88444-81-9   
C16H8F6N2O4 

[1]BioorganicandMedicinalChemistry,2017,vol.25,p.1465-1470

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