Home Nitriles 5-Amino-3-methyl-isothiazole-4-carbonitrile

5-Amino-3-methyl-isothiazole-4-carbonitrile

CAS No.:
41808-35-9
Catalog Number:
AG00C7M9
Molecular Formula:
C5H5N3S
Molecular Weight:
139.1783
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$70
- +
250mg
95%
In Stock USA
United States
$126
- +
1g
95%
In Stock USA
United States
$252
- +
5g
95%
In Stock USA
United States
$756
- +
Product Description
Catalog Number:
AG00C7M9
Chemical Name:
5-Amino-3-methyl-isothiazole-4-carbonitrile
CAS Number:
41808-35-9
Molecular Formula:
C5H5N3S
Molecular Weight:
139.1783
MDL Number:
MFCD03422694
IUPAC Name:
5-amino-3-methyl-1,2-thiazole-4-carbonitrile
InChI:
InChI=1S/C5H5N3S/c1-3-4(2-6)5(7)9-8-3/h7H2,1H3
InChI Key:
PJQFZPWSFDVYIF-UHFFFAOYSA-N
SMILES:
N#Cc1c(N)snc1C
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.02g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.176g/mol
Monoisotopic Mass:
139.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
90.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties