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24783-42-4 | 2-Pyridineacetonitrile, 6-chloro-α-phenyl-
CAS No: 24783-42-4 Catalog No: AG002PFD MDL No:MFCD00172233
Product Description
Catalog Number:
AG002PFD
Chemical Name:
2-Pyridineacetonitrile, 6-chloro-α-phenyl-
CAS Number:
24783-42-4
Molecular Formula:
C13H9ClN2
Molecular Weight:
228.6770
MDL Number:
MFCD00172233
IUPAC Name:
2-(6-chloropyridin-2-yl)-2-phenylacetonitrile
InChI:
InChI=1S/C13H9ClN2/c14-13-8-4-7-12(16-13)11(9-15)10-5-2-1-3-6-10/h1-8,11H
InChI Key:
GETLPXGITMSNKU-UHFFFAOYSA-N
SMILES:
N#CC(c1cccc(n1)Cl)c1ccccc1
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.045g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.679g/mol
Monoisotopic Mass:
228.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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 |
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