Home Nitriles 4-(2-Oxopyrrolidin-1-yl)benzonitrile

4-(2-Oxopyrrolidin-1-yl)benzonitrile

CAS No.:
167833-93-4
Catalog Number:
AG00AC8Z
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$75
- +
5g
95%
In Stock USA
United States
$225
- +
25g
95%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG00AC8Z
Chemical Name:
4-(2-Oxopyrrolidin-1-yl)benzonitrile
CAS Number:
167833-93-4
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD07345520
IUPAC Name:
4-(2-oxopyrrolidin-1-yl)benzonitrile
InChI:
InChI=1S/C11H10N2O/c12-8-9-3-5-10(6-4-9)13-7-1-2-11(13)14/h3-6H,1-2,7H2
InChI Key:
RDKSGTMGEPJKLW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)N1CCCC1=O
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties