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Home > Quinoline > 829666-42-4
829666-42-4 | [8,8'-Biquinoline]-7,7'-diol
CAS No: 829666-42-4 Catalog No: AG004YIY MDL No:
Product Description
Catalog Number:
AG004YIY
Chemical Name:
[8,8'-Biquinoline]-7,7'-diol
CAS Number:
829666-42-4
Molecular Formula:
C18H12N2O2
Molecular Weight:
288.3001
IUPAC Name:
8-(7-hydroxyquinolin-8-yl)quinolin-7-ol
InChI:
InChI=1S/C18H12N2O2/c21-13-7-5-11-3-1-9-19-17(11)15(13)16-14(22)8-6-12-4-2-10-20-18(12)16/h1-10,21-22H
InChI Key:
UCDMRGUGNJSADT-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1c1c(O)ccc3c1nccc3)nccc2
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.09g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.306g/mol
Monoisotopic Mass:
288.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Synthesis of 7,7'-dihydroxy-8,8'-biquinolyl (azaBINOL) via Pd-catalyzed directed double C-H functionalization of 8,8'-biquinolyl: emergence of an atropos from a tropos state. | Organic letters 20110805 |
| Resolution, enantiomerization kinetics, and chiroptical properties of 7,7'-dihydroxy-8,8'-biquinolyl. | The Journal of organic chemistry 20061013 |
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