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57954-94-6

57954-94-6 | 2-(4-CYANOBENZOYL)PYRIDINE

CAS No: 57954-94-6 Catalog No: AG00EERT MDL No:MFCD07699243

Product Description

Catalog Number:
AG00EERT
Chemical Name:
2-(4-CYANOBENZOYL)PYRIDINE
CAS Number:
57954-94-6
MDL Number:
MFCD07699243
IUPAC Name:
4-(pyridine-2-carbonyl)benzonitrile
InChI:
InChI=1S/C13H8N2O/c14-9-10-4-6-11(7-5-10)13(16)12-3-1-2-8-15-12/h1-8H
InChI Key:
JWCRAYQKASCIMD-UHFFFAOYSA-N

Properties

Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.22g/mol
Monoisotopic Mass:
208.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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