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17295-11-3 | Methyl 6-hydroxy-2-naphthoate
CAS No: 17295-11-3 Catalog No: AG003RYJ MDL No:MFCD00100526
Product Description
Catalog Number:
AG003RYJ
Chemical Name:
Methyl 6-hydroxy-2-naphthoate
CAS Number:
17295-11-3
Molecular Formula:
C12H10O3
Molecular Weight:
202.2060
MDL Number:
MFCD00100526
IUPAC Name:
methyl 6-hydroxynaphthalene-2-carboxylate
InChI:
InChI=1S/C12H10O3/c1-15-12(14)10-3-2-9-7-11(13)5-4-8(9)6-10/h2-7,13H,1H3
InChI Key:
UKZOPQRTQJERQC-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)ccc(c2)O
NSC Number:
689401
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.063g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.209g/mol
Monoisotopic Mass:
202.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Arylamide inhibitors of HIV-1 integrase. | Journal of medicinal chemistry 19970411 |
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