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Home > Pyridines > 113480-18-5
113480-18-5 | Pyridinium, 1-(2-hydroxyethyl)-4-[2-(1-naphthalenyl)ethenyl]-
CAS No: 113480-18-5 Catalog No: AG0008QB MDL No:
Product Description
Catalog Number:
AG0008QB
Chemical Name:
Pyridinium, 1-(2-hydroxyethyl)-4-[2-(1-naphthalenyl)ethenyl]-
CAS Number:
113480-18-5
Molecular Formula:
C19H18NO+
Molecular Weight:
276.3523
IUPAC Name:
2-[4-(2-naphthalen-1-ylethenyl)pyridin-1-ium-1-yl]ethanol
InChI:
InChI=1S/C19H18NO/c21-15-14-20-12-10-16(11-13-20)8-9-18-6-3-5-17-4-1-2-7-19(17)18/h1-13,21H,14-15H2/q+1
InChI Key:
WNTAGROULYXPJU-UHFFFAOYSA-N
SMILES:
OCC[n+]1ccc(cc1)C=Cc1cccc2c1cccc2
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.139g/mol
Formal Charge:
1
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.359g/mol
Monoisotopic Mass:
276.139g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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