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Home Other Building Blocks 1H-Pyrazole-3,4-diamine

1H-Pyrazole-3,4-diamine

CAS No.:
16461-98-6
Catalog Number:
AG001UYW
Molecular Formula:
C3H6N4
Molecular Weight:
98.1065
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$358
- +
5g
95%
In Stock USA
United States
$1136
- +
Product Description
Catalog Number:
AG001UYW
Chemical Name:
1H-Pyrazole-3,4-diamine
CAS Number:
16461-98-6
Molecular Formula:
C3H6N4
Molecular Weight:
98.1065
MDL Number:
MFCD14616008
IUPAC Name:
1H-pyrazole-4,5-diamine
InChI:
InChI=1S/C3H6N4/c4-2-1-6-7-3(2)5/h1H,4H2,(H3,5,6,7)
InChI Key:
LHGQFZQWSOXLEW-UHFFFAOYSA-N
SMILES:
Nc1n[nH]cc1N
Properties
Complexity:
64  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.059g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
98.109g/mol
Monoisotopic Mass:
98.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Literature
Title Journal
Novel synthesis of 5-amino-3-bromo-1-(tert-butyl)-1H-pyrazole-4-carbonitrile: a versatile intermediate for the preparation of 5-amino-3-aryl-1-(tert-butyl)-1H-pyrazole-4-carboxamides. Organic letters 20120803
The CDK9 C-helix exhibits conformational plasticity that may explain the selectivity of CAN508. ACS chemical biology 20120518
Pyrazolyl-diamine ligands that bear anthracenyl moieties and their rhenium(I) tricarbonyl complexes: synthesis, characterisation and DNA-binding properties. Chembiochem : a European journal of chemical biology 20080104
Properties