Home Sulfos Aminomalononitrile p-toluenesulfonate

Aminomalononitrile p-toluenesulfonate

CAS No.:
5098-14-6
Catalog Number:
AG00374W
Molecular Formula:
C10H11N3O3S
Molecular Weight:
253.2776
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$57
- +
10g
95%
In Stock USA
United States
$94
- +
25g
95%
In Stock USA
United States
$188
- +
100g
95%
In Stock USA
United States
$525
- +
Product Description
Catalog Number:
AG00374W
Chemical Name:
Aminomalononitrile p-toluenesulfonate
CAS Number:
5098-14-6
Molecular Formula:
C10H11N3O3S
Molecular Weight:
253.2776
MDL Number:
MFCD00012848
IUPAC Name:
2-aminopropanedinitrile;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C7H8O3S.C3H3N3/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-3(6)2-5/h2-5H,1H3,(H,8,9,10);3H,6H2
InChI Key:
MEUWQVWJLLBVQI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)O.NC(C#N)C#N
EC Number:
225-817-1
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.052g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.276g/mol
Monoisotopic Mass:
253.052g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
136A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties