Home Nitriles 2-Thenoylacetonitrile

2-Thenoylacetonitrile

CAS No.:
33898-90-7
Catalog Number:
AG003B9T
Molecular Formula:
C7H5NOS
Molecular Weight:
151.1857
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$23
- +
5g
95%
In Stock USA
United States
$75
- +
25g
95%
In Stock USA
United States
$300
- +
100g
95%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG003B9T
Chemical Name:
2-Thenoylacetonitrile
CAS Number:
33898-90-7
Molecular Formula:
C7H5NOS
Molecular Weight:
151.1857
MDL Number:
MFCD00052586
IUPAC Name:
3-oxo-3-thiophen-2-ylpropanenitrile
InChI:
InChI=1S/C7H5NOS/c8-4-3-6(9)7-2-1-5-10-7/h1-2,5H,3H2
InChI Key:
XWWUQBHVRILEPB-UHFFFAOYSA-N
SMILES:
N#CCC(=O)c1cccs1
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.009g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.183g/mol
Monoisotopic Mass:
151.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties