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83470-22-8

83470-22-8 | 2-Butanone, 4-phenyl-4-(2-pyridinyl)-

CAS No: 83470-22-8 Catalog No: AG004RDF MDL No:

Product Description

Catalog Number:
AG004RDF
Chemical Name:
2-Butanone, 4-phenyl-4-(2-pyridinyl)-
CAS Number:
83470-22-8
Molecular Formula:
C15H15NO
Molecular Weight:
225.2857
IUPAC Name:
4-phenyl-4-pyridin-2-ylbutan-2-one
InChI:
InChI=1S/C15H15NO/c1-12(17)11-14(13-7-3-2-4-8-13)15-9-5-6-10-16-15/h2-10,14H,11H2,1H3
InChI Key:
NFOWVKNIOHUCBQ-UHFFFAOYSA-N
SMILES:
CC(=O)CC(c1ccccn1)c1ccccc1

Properties

Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.115g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.291g/mol
Monoisotopic Mass:
225.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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