Home Nitriles 2H-1,2,4-Triazole-3-carbonitrile

2H-1,2,4-Triazole-3-carbonitrile

CAS No.:
3641-10-9
Catalog Number:
AG0033OQ
Molecular Formula:
C3H2N4
Molecular Weight:
94.0748
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$32
- +
25g
98%
In Stock USA
United States
$113
- +
100g
98%
In Stock USA
United States
$338
- +
Product Description
Catalog Number:
AG0033OQ
Chemical Name:
2H-1,2,4-Triazole-3-carbonitrile
CAS Number:
3641-10-9
Molecular Formula:
C3H2N4
Molecular Weight:
94.0748
MDL Number:
MFCD03428509
IUPAC Name:
1H-1,2,4-triazole-5-carbonitrile
InChI:
InChI=1S/C3H2N4/c4-1-3-5-2-6-7-3/h2H,(H,5,6,7)
InChI Key:
GUQHFZFTGHNVDG-UHFFFAOYSA-N
SMILES:
c1nc([nH]n1)C#N
EC Number:
609-243-2
Properties
Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.028g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
94.077g/mol
Monoisotopic Mass:
94.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties