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116610-69-6

116610-69-6 | Pyridine, 2-(2-methylphenyl)-4-(methylthio)-6-phenyl-

CAS No: 116610-69-6 Catalog No: AG000CVU MDL No:

Product Description

Catalog Number:
AG000CVU
Chemical Name:
Pyridine, 2-(2-methylphenyl)-4-(methylthio)-6-phenyl-
CAS Number:
116610-69-6
Molecular Formula:
C19H17NS
Molecular Weight:
291.4100
IUPAC Name:
2-(2-methylphenyl)-4-methylsulfanyl-6-phenylpyridine
InChI:
InChI=1S/C19H17NS/c1-14-8-6-7-11-17(14)19-13-16(21-2)12-18(20-19)15-9-4-3-5-10-15/h3-13H,1-2H3
InChI Key:
BUXYOEPHDOCXKB-UHFFFAOYSA-N
SMILES:
CSc1cc(nc(c1)c1ccccc1C)c1ccccc1

Properties

Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.108g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.412g/mol
Monoisotopic Mass:
291.108g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  

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