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77669-18-2 | Quinoline, 2-[(1E)-2-(2-methoxyphenyl)ethenyl]-
CAS No: 77669-18-2 Catalog No: AG008OMJ MDL No:
Product Description
Catalog Number:
AG008OMJ
Chemical Name:
Quinoline, 2-[(1E)-2-(2-methoxyphenyl)ethenyl]-
CAS Number:
77669-18-2
Molecular Formula:
C18H15NO
Molecular Weight:
261.3178
IUPAC Name:
2-[2-(2-methoxyphenyl)ethenyl]quinoline
InChI:
InChI=1S/C18H15NO/c1-20-18-9-5-3-7-15(18)11-13-16-12-10-14-6-2-4-8-17(14)19-16/h2-13H,1H3
InChI Key:
CRKXXGYVXSKYIV-UHFFFAOYSA-N
SMILES:
COc1ccccc1/C=C/c1ccc2c(n1)cccc2
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.115g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.324g/mol
Monoisotopic Mass:
261.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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