Home Nitriles 3-(3-Chlorophenethyl)picolinonitrile

3-(3-Chlorophenethyl)picolinonitrile

CAS No.:
31255-57-9
Catalog Number:
AG00JKHE
Molecular Formula:
C14H11ClN2
Molecular Weight:
242.7035
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25mg
99%(GC)powder
In Stock USA
United States
$87
- +
100mg
99%(GC)powder
In Stock USA
United States
$155
- +
Product Description
Catalog Number:
AG00JKHE
Chemical Name:
3-(3-Chlorophenethyl)picolinonitrile
CAS Number:
31255-57-9
Molecular Formula:
C14H11ClN2
Molecular Weight:
242.7035
MDL Number:
MFCD02942420
IUPAC Name:
3-[2-(3-chlorophenyl)ethyl]pyridine-2-carbonitrile
InChI:
InChI=1S/C14H11ClN2/c15-13-5-1-3-11(9-13)6-7-12-4-2-8-17-14(12)10-16/h1-5,8-9H,6-7H2
InChI Key:
JPCGKKFEDUHGDF-UHFFFAOYSA-N
SMILES:
N#Cc1ncccc1CCc1cccc(c1)Cl
EC Number:
608-594-9
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.061g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.706g/mol
Monoisotopic Mass:
242.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties