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16462-27-4,MFCD00085600
Catalog No.:AA001UXA

16462-27-4 | 2,4-Diaminopyrimidine-5-carbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$35.00   $25.00
- +
5g
95%
in stock  
$93.00   $65.00
- +
25g
95%
in stock  
$341.00   $239.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001UXA
Chemical Name:
2,4-Diaminopyrimidine-5-carbonitrile
CAS Number:
16462-27-4
Molecular Formula:
C5H5N5
Molecular Weight:
135.1267
MDL Number:
MFCD00085600
SMILES:
N#Cc1cnc(nc1N)N
NSC Number:
135235
Properties
Computed Properties
 
Complexity:
159  
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:
5  
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  

Literature

Title: 7'-Amino-1'H-spiro-[cyclo-heptane-1,2'-pyrimido[4,5-d]pyrimidin]-4'(3'H)-one.

Journal: Acta crystallographica. Section E, Structure reports online 20120801

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Tags:16462-27-4 Molecular Formula|16462-27-4 MDL|16462-27-4 SMILES|16462-27-4 2,4-Diaminopyrimidine-5-carbonitrile
Catalog No.: AA001UXA
16462-27-4,MFCD00085600
16462-27-4 | 2,4-Diaminopyrimidine-5-carbonitrile
Pack Size： 1g
Purity： 95%
in stock
$35.00 $25.00
Pack Size： 5g
Purity： 95%
in stock
$93.00 $65.00
Pack Size： 25g
Purity： 95%
in stock
$341.00 $239.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001UXA
Chemical Name: 2,4-Diaminopyrimidine-5-carbonitrile
CAS Number: 16462-27-4
Molecular Formula: C5H5N5
Molecular Weight: 135.1267
MDL Number: MFCD00085600
SMILES: N#Cc1cnc(nc1N)N
NSC Number: 135235
Properties
Complexity: 159  
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: 5  
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  
Literature fold

Title: 7'-Amino-1'H-spiro-[cyclo-heptane-1,2'-pyrimido[4,5-d]pyrimidin]-4'(3'H)-one.

Journal: Acta crystallographica. Section E, Structure reports online20120801

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