Home Other Building Blocks 4-Chloro-n-(4-cyanophenyl)butanamide

4-Chloro-n-(4-cyanophenyl)butanamide

CAS No.:
1016674-12-6
Catalog Number:
AG00054S
Molecular Formula:
C11H11ClN2O
Molecular Weight:
222.6708
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00054S
Chemical Name:
4-Chloro-n-(4-cyanophenyl)butanamide
CAS Number:
1016674-12-6
Molecular Formula:
C11H11ClN2O
Molecular Weight:
222.6708
MDL Number:
MFCD09928490
IUPAC Name:
4-chloro-N-(4-cyanophenyl)butanamide
InChI:
InChI=1S/C11H11ClN2O/c12-7-1-2-11(15)14-10-5-3-9(8-13)4-6-10/h3-6H,1-2,7H2,(H,14,15)
InChI Key:
RCFZGBXDYJPYFR-UHFFFAOYSA-N
SMILES:
ClCCCC(=O)Nc1ccc(cc1)C#N
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.056g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.672g/mol
Monoisotopic Mass:
222.056g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties