Home Nitriles 2-(3-Chlorophenyl)sulfanylacetonitrile

2-(3-Chlorophenyl)sulfanylacetonitrile

CAS No.:
18527-22-5
Catalog Number:
AG01FCT9
Molecular Formula:
C8H6ClNS
Molecular Weight:
183.6579
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$149
- +
1g
95%
1 week
United States
$260
- +
5g
95%
1 week
United States
$705
- +
25g
95%
1 week
United States
$2052
- +
Product Description
Catalog Number:
AG01FCT9
Chemical Name:
2-(3-Chlorophenyl)sulfanylacetonitrile
CAS Number:
18527-22-5
Molecular Formula:
C8H6ClNS
Molecular Weight:
183.6579
MDL Number:
MFCD16835766
IUPAC Name:
2-(3-chlorophenyl)sulfanylacetonitrile
InChI:
InChI=1S/C8H6ClNS/c9-7-2-1-3-8(6-7)11-5-4-10/h1-3,6H,5H2
InChI Key:
GHHDWNWISOJDOK-UHFFFAOYSA-N
SMILES:
N#CCSc1cccc(c1)Cl
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.991g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.653g/mol
Monoisotopic Mass:
182.991g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties