Home Nitriles Benzo[b]thiophene-7-carbonitrile

Benzo[b]thiophene-7-carbonitrile

CAS No.:
22780-71-8
Catalog Number:
AG00BFFP
Molecular Formula:
C9H5NS
Molecular Weight:
159.2077
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$238
- +
5g
97%
In Stock USA
United States
$950
- +
Product Description
Catalog Number:
AG00BFFP
Chemical Name:
Benzo[b]thiophene-7-carbonitrile
CAS Number:
22780-71-8
Molecular Formula:
C9H5NS
Molecular Weight:
159.2077
MDL Number:
MFCD08706245
IUPAC Name:
1-benzothiophene-7-carbonitrile
InChI:
InChI=1S/C9H5NS/c10-6-8-3-1-2-7-4-5-11-9(7)8/h1-5H
InChI Key:
DRNFPCFRKOZEPV-UHFFFAOYSA-N
SMILES:
N#Cc1cccc2c1scc2
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.014g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.206g/mol
Monoisotopic Mass:
159.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties