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Home > Aldehydes > 1263287-73-5
1263287-73-5 | 7-Quinolinecarboxaldehyde, 2-[2-(3,4-dihydroxy-5-methoxyphenyl)ethenyl]-8-hydroxy-
CAS No: 1263287-73-5 Catalog No: AG000SN3 MDL No:
Product Description
Catalog Number:
AG000SN3
Chemical Name:
7-Quinolinecarboxaldehyde, 2-[2-(3,4-dihydroxy-5-methoxyphenyl)ethenyl]-8-hydroxy-
CAS Number:
1263287-73-5
Molecular Formula:
C19H15NO5
Molecular Weight:
337.3261
IUPAC Name:
2-[(E)-2-(3,4-dihydroxy-5-methoxyphenyl)ethenyl]-8-hydroxyquinoline-7-carbaldehyde
InChI:
InChI=1S/C19H15NO5/c1-25-16-9-11(8-15(22)19(16)24)2-6-14-7-5-12-3-4-13(10-21)18(23)17(12)20-14/h2-10,22-24H,1H3/b6-2+
InChI Key:
FESVWPFJUBUQAT-QHHAFSJGSA-N
SMILES:
O=Cc1ccc2c(c1O)nc(cc2)C=Cc1cc(O)c(c(c1)OC)O
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
337.095g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
337.331g/mol
Monoisotopic Mass:
337.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
99.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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