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918341-19-2

918341-19-2 | Quinoline, 3-[(1E)-2-(methylsulfonyl)ethenyl]-

CAS No: 918341-19-2 Catalog No: AG006G4N MDL No:

Product Description

Catalog Number:
AG006G4N
Chemical Name:
Quinoline, 3-[(1E)-2-(methylsulfonyl)ethenyl]-
CAS Number:
918341-19-2
Molecular Formula:
C12H11NO2S
Molecular Weight:
233.2862
IUPAC Name:
3-(2-methylsulfonylethenyl)quinoline
InChI:
InChI=1S/C12H11NO2S/c1-16(14,15)7-6-10-8-11-4-2-3-5-12(11)13-9-10/h2-9H,1H3
InChI Key:
VITAAAAERAZYKH-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)/C=C/c1cnc2c(c1)cccc2

Properties

Complexity:
356  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.285g/mol
Monoisotopic Mass:
233.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.8  

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