6-Methoxy-2-naphthylacetic acid

C₁₃H₁₂O₃CAS 23981-47-7216.24 g/mol

Open in Covalent MOL file

Carboxylic acid Ether

Properties

Molecular formula: C₁₃H₁₂O₃
Molar mass: 216.24 g/mol
Exact mass: 216.0786 Da
Melting point: 203–205 °C
logP: 2.48Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Identifiers

CAS number

23981-47-7

SMILES

COc1ccc2cc(CC(=O)O)ccc2c1

InChIKey

PHJFLPMVEFKEPL-UHFFFAOYSA-N

InChI

InChI=1S/C13H12O3/c1-16-12-5-4-10-6-9(7-13(14)15)2-3-11(10)8-12/h2-6,8H,7H2,1H3,(H,14,15)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names

2-Naphthaleneacetic acid, 6-methoxy-
6-Methoxy-2-naphthaleneacetic acid
2-(6-Methoxy-2-naphthyl)acetic acid
BRL 10720
2-(2-Methoxynaphthalen-6-yl)acetic acid
2-(6-Methoxynaphthalen-2-yl)acetic acid
2-(6-Methoxynaphthalen-2-yl)aceticacid

Work with 6-Methoxy-2-naphthylacetic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(4-Methoxyphenyl)acetic acid104-01-871 % similar (3-Methoxyphenyl)acetic acid1798-09-068 % similar (3,5-Dimethoxyphenyl)acetic acid4670-10-462 % similar 2-Naphthaleneacetic acid581-96-462 % similar 2,5-Dimethoxyphenylacetic acid1758-25-459 % similar 3-Hydroxy-4-methoxybenzeneacetic acid1131-94-857 % similar Homovanillic acid306-08-157 % similar (3-Fluoro-4-methoxyphenyl)acetic acid452-14-257 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Ethoxy-1-naphthalenecarboxylic acid2224-00-2 7-Methoxy-1-naphthaleneacetic acid6836-22-2

Elsewhere

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