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Home > Pyridines > 870082-57-8
870082-57-8 | Pyridine, 2-[[(1E)-2-phenylethenyl]sulfonyl]-
CAS No: 870082-57-8 Catalog No: AG004GR3 MDL No:
Product Description
Catalog Number:
AG004GR3
Chemical Name:
Pyridine, 2-[[(1E)-2-phenylethenyl]sulfonyl]-
CAS Number:
870082-57-8
Molecular Formula:
C13H11NO2S
Molecular Weight:
245.2969
IUPAC Name:
2-(2-phenylethenylsulfonyl)pyridine
InChI:
InChI=1S/C13H11NO2S/c15-17(16,13-8-4-5-10-14-13)11-9-12-6-2-1-3-7-12/h1-11H
InChI Key:
IUHYSWACRYSBES-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccn1)/C=C/c1ccccc1
Properties
Complexity:
350
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.051g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.296g/mol
Monoisotopic Mass:
245.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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