Home Other Building Blocks 4-Cyanopyrazole

4-Cyanopyrazole

CAS No.:
31108-57-3
Catalog Number:
AG0032RX
Molecular Formula:
C4H3N3
Molecular Weight:
93.0867
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$50
- +
5g
96%
In Stock USA
United States
$138
- +
10g
96%
In Stock USA
United States
$200
- +
25g
96%
In Stock USA
United States
$463
- +
100g
96%
In Stock USA
United States
$1438
- +
Product Description
Catalog Number:
AG0032RX
Chemical Name:
4-Cyanopyrazole
CAS Number:
31108-57-3
Molecular Formula:
C4H3N3
Molecular Weight:
93.0867
MDL Number:
MFCD00040250
IUPAC Name:
1H-pyrazole-4-carbonitrile
InChI:
InChI=1S/C4H3N3/c5-1-4-2-6-7-3-4/h2-3H,(H,6,7)
InChI Key:
NUGZBVBZIDWZAD-UHFFFAOYSA-N
SMILES:
N#Cc1c[nH]nc1
Properties
Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
93.033g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
93.089g/mol
Monoisotopic Mass:
93.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Synthesis and anti-inflammatory evaluation of new substituted 1-(3-chlorophenyl)-3-(4-methoxyphenyl)-1H-pyrazole derivatives. Acta poloniae pharmaceutica 20120101
3-Oxo-5-(piperidin-1-yl)-2,3-dihydro-1H-pyrazole-4-carbonitrile. Acta crystallographica. Section E, Structure reports online 20111201
Properties