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10177-10-3 | 3-Pyridinecarbonitrile, 2-chloro-5-phenyl-
CAS No: 10177-10-3 Catalog No: AG0005G7 MDL No:MFCD00231610
Product Description
Catalog Number:
AG0005G7
Chemical Name:
3-Pyridinecarbonitrile, 2-chloro-5-phenyl-
CAS Number:
10177-10-3
Molecular Formula:
C12H7ClN2
Molecular Weight:
214.6504
MDL Number:
MFCD00231610
IUPAC Name:
2-chloro-5-phenylpyridine-3-carbonitrile
InChI:
InChI=1S/C12H7ClN2/c13-12-10(7-14)6-11(8-15-12)9-4-2-1-3-5-9/h1-6,8H
InChI Key:
DBOYDCQWVLJOJG-UHFFFAOYSA-N
SMILES:
N#Cc1cc(cnc1Cl)c1ccccc1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.03g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.652g/mol
Monoisotopic Mass:
214.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
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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