Home Nitriles 4-(2-Formyl-1h-pyrrol-1-yl)benzonitrile

4-(2-Formyl-1h-pyrrol-1-yl)benzonitrile

CAS No.:
169036-66-2
Catalog Number:
AG001YGL
Molecular Formula:
C12H8N2O
Molecular Weight:
196.2047
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$113
- +
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG001YGL
Chemical Name:
4-(2-Formyl-1h-pyrrol-1-yl)benzonitrile
CAS Number:
169036-66-2
Molecular Formula:
C12H8N2O
Molecular Weight:
196.2047
MDL Number:
MFCD02664880
IUPAC Name:
4-(2-formylpyrrol-1-yl)benzonitrile
InChI:
InChI=1S/C12H8N2O/c13-8-10-3-5-11(6-4-10)14-7-1-2-12(14)9-15/h1-7,9H
InChI Key:
GDOFODUEPBBDMO-UHFFFAOYSA-N
SMILES:
O=Cc1cccn1c1ccc(cc1)C#N
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.064g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.209g/mol
Monoisotopic Mass:
196.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties