Home Nitriles 5-Aminoisoxazole-4-carbonitrile

5-Aminoisoxazole-4-carbonitrile

CAS No.:
98027-17-9
Catalog Number:
AG003MEC
Molecular Formula:
C4H3N3O
Molecular Weight:
109.0861
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
- +
5g
95%
In Stock USA
United States
$444
- +
Product Description
Catalog Number:
AG003MEC
Chemical Name:
5-Aminoisoxazole-4-carbonitrile
CAS Number:
98027-17-9
Molecular Formula:
C4H3N3O
Molecular Weight:
109.0861
MDL Number:
MFCD00128284
IUPAC Name:
5-amino-1,2-oxazole-4-carbonitrile
InChI:
InChI=1S/C4H3N3O/c5-1-3-2-7-8-4(3)6/h2H,6H2
InChI Key:
HAZRYIRJNFYOLH-UHFFFAOYSA-N
SMILES:
Nc1oncc1C#N
NSC Number:
220469
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.028g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
109.088g/mol
Monoisotopic Mass:
109.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties