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70121-93-6 | Ethanone, 1-(2,4-dihydroxyphenyl)-2-(2-quinolinyl)-
CAS No: 70121-93-6 Catalog No: AG006C9I MDL No:
Product Description
Catalog Number:
AG006C9I
Chemical Name:
Ethanone, 1-(2,4-dihydroxyphenyl)-2-(2-quinolinyl)-
CAS Number:
70121-93-6
Molecular Formula:
C17H13NO3
Molecular Weight:
279.2900
IUPAC Name:
1-(2,4-dihydroxyphenyl)-2-quinolin-2-ylethanone
InChI:
InChI=1S/C17H13NO3/c19-13-7-8-14(17(21)10-13)16(20)9-12-6-5-11-3-1-2-4-15(11)18-12/h1-8,10,19,21H,9H2
InChI Key:
DCRSUQKNMAIJMA-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)O)C(=O)Cc1ccc2c(n1)cccc2
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.09g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
279.295g/mol
Monoisotopic Mass:
279.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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