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189506-01-2 | 8-Quinolinol, 2-[2-(2-hydroxy-1-naphthalenyl)ethenyl]-, hydrochloride
CAS No: 189506-01-2 Catalog No: AG00770X MDL No:
Product Description
Catalog Number:
AG00770X
Chemical Name:
8-Quinolinol, 2-[2-(2-hydroxy-1-naphthalenyl)ethenyl]-, hydrochloride
CAS Number:
189506-01-2
Molecular Formula:
C21H16ClNO2
Molecular Weight:
349.8102
IUPAC Name:
2-[2-(2-hydroxynaphthalen-1-yl)ethenyl]quinolin-8-ol;hydrochloride
InChI:
InChI=1S/C21H15NO2.ClH/c23-19-13-9-14-4-1-2-6-17(14)18(19)12-11-16-10-8-15-5-3-7-20(24)21(15)22-16;/h1-13,23-24H;1H
InChI Key:
GQAVZEJIROHEKP-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1C=Cc1ccc3c(n1)c(O)ccc3)cccc2.Cl
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.087g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
349.814g/mol
Monoisotopic Mass:
349.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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