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13041-60-6 | 2-Naphthalenecarboxylic acid, 3-methoxy-, methyl ester
CAS No: 13041-60-6 Catalog No: AG000UEL MDL No:MFCD00454253
Product Description
Catalog Number:
AG000UEL
Chemical Name:
2-Naphthalenecarboxylic acid, 3-methoxy-, methyl ester
CAS Number:
13041-60-6
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
MDL Number:
MFCD00454253
IUPAC Name:
methyl 3-methoxynaphthalene-2-carboxylate
InChI:
InChI=1S/C13H12O3/c1-15-12-8-10-6-4-3-5-9(10)7-11(12)13(14)16-2/h3-8H,1-2H3
InChI Key:
MPLSAOVNAXJHHI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2ccccc2cc1OC
NSC Number:
167526
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.236g/mol
Monoisotopic Mass:
216.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Literature
| Title | Journal |
|---|---|
| Stepwise photochemical-chiral delivery in gamma-cyclodextrin-directed enantioselective photocyclodimerization of methyl 3-methoxyl-2-naphthoate in aqueous solution. | Langmuir : the ACS journal of surfaces and colloids 20100119 |
| Gamma-cyclodextrin-directed enantioselective photocyclodimerization of methyl 3-methoxyl-2-naphthoate. | The Journal of organic chemistry 20090501 |
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