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54385-49-8,MFCD06661878
Catalog No.:AA00DFWZ

54385-49-8 | 5-Amino-1h-pyrazole-3,4-dicarbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$99.00   $69.00
- +
250mg
95%
in stock  
$178.00   $125.00
- +
1g
95%
in stock  
$400.00   $280.00
- +
5g
95%
in stock  
$1,385.00 $969.00
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DFWZ
Chemical Name:
5-Amino-1h-pyrazole-3,4-dicarbonitrile
CAS Number:
54385-49-8
Molecular Formula:
C5H3N5
Molecular Weight:
133.1108
MDL Number:
MFCD06661878
SMILES:
N#Cc1n[nH]c(c1C#N)N
NSC Number:
363020
Properties
Computed Properties
 
Complexity:
217  
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:
4  
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  

Upstream Synthesis Route

[1]Patent:JP5654467,2015,B2,.Locationinpatent:Paragraph0082-0084

[2]Patent:WO2018/89786,2018,A1,.Locationinpatent:Paragraph00177

[1]Patent:US5294612,1994,A,

Downstream Synthesis Route

[1]ChemistryofHeterocyclicCompounds,1979,vol.15,p.1361-1366    KhimiyaGeterotsiklicheskikhSoedinenii,1979,vol.15,p.1687-1692

[1]JournalofHeterocyclicChemistry,1989,vol.26,p.613-618

[1]ChemistryofHeterocyclicCompounds,1982,vol.18,p.1302-1305    KhimiyaGeterotsiklicheskikhSoedinenii,1982,vol.18,p.1682-1685

[2]ChemistryofHeterocyclicCompounds,1984,vol.20,p.210-215    KhimiyaGeterotsiklicheskikhSoedinenii,1984,vol.20,p.253-258

[1]ChemistryofHeterocyclicCompounds,1982,vol.18,p.1302-1305    KhimiyaGeterotsiklicheskikhSoedinenii,1982,vol.18,p.1682-1685

[1]ChemistryofHeterocyclicCompounds,1984,vol.20,p.215-221    KhimiyaGeterotsiklicheskikhSoedinenii,1984,vol.20,p.259-264

Literature
Quotation Request
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SDS
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Tags:54385-49-8 Molecular Formula|54385-49-8 MDL|54385-49-8 SMILES|54385-49-8 5-Amino-1h-pyrazole-3,4-dicarbonitrile
Catalog No.: AA00DFWZ
54385-49-8,MFCD06661878
54385-49-8 | 5-Amino-1h-pyrazole-3,4-dicarbonitrile
Pack Size： 100mg
Purity： 95%
in stock
$99.00 $69.00
Pack Size： 250mg
Purity： 95%
in stock
$178.00 $125.00
Pack Size： 1g
Purity： 95%
in stock
$400.00 $280.00
Pack Size： 5g
Purity： 95%
in stock
$1,385.00 $969.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DFWZ
Chemical Name: 5-Amino-1h-pyrazole-3,4-dicarbonitrile
CAS Number: 54385-49-8
Molecular Formula: C5H3N5
Molecular Weight: 133.1108
MDL Number: MFCD06661878
SMILES: N#Cc1n[nH]c(c1C#N)N
NSC Number: 363020
Properties
Complexity: 217  
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: 4  
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  
Upstream Synthesis Route
870-46-2    670-54-2    54385-49-8 

[1]Patent:JP5654467,2015,B2,.Locationinpatent:Paragraph0082-0084

[2]Patent:WO2018/89786,2018,A1,.Locationinpatent:Paragraph00177

5745-84-6    54385-49-8 

[1]Patent:US5294612,1994,A,

Downstream Synthesis Route
75-15-0    54385-49-8    73236-29-0 

[1]ChemistryofHeterocyclicCompounds,1979,vol.15,p.1361-1366    KhimiyaGeterotsiklicheskikhSoedinenii,1979,vol.15,p.1687-1692

94-99-5    54385-49-8    125240-79-1 

[1]JournalofHeterocyclicChemistry,1989,vol.26,p.613-618

122-51-0    54385-49-8    84941-17-3 

[1]ChemistryofHeterocyclicCompounds,1982,vol.18,p.1302-1305    KhimiyaGeterotsiklicheskikhSoedinenii,1982,vol.18,p.1682-1685

[2]ChemistryofHeterocyclicCompounds,1984,vol.20,p.210-215    KhimiyaGeterotsiklicheskikhSoedinenii,1984,vol.20,p.253-258

122-51-0    54385-49-8    84941-21-9    84941-18-4    84941-17-3 

[1]ChemistryofHeterocyclicCompounds,1982,vol.18,p.1302-1305    KhimiyaGeterotsiklicheskikhSoedinenii,1982,vol.18,p.1682-1685

54385-49-8    1188-33-6    90167-35-4 

[1]ChemistryofHeterocyclicCompounds,1984,vol.20,p.215-221    KhimiyaGeterotsiklicheskikhSoedinenii,1984,vol.20,p.259-264

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169758-66-1
169758-66-1
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