7-Methoxy-1-tetralone

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For Research Use Only.

Category

Impurities

Cat.No.

NP3695

CAS

6836-19-7

Product Name

7-Methoxy-1-tetralone

Structure

Product Details

Description

7-Methoxy-1-tetralone is an impurity of Agomelatine, which is a melatoninergic agonist and selective antagonist of 5-HT2C receptors.

Synonyms

1(2H)-Naphthalenone, 3,4-dihydro-7-methoxy-; 3,4-Dihydro-7-methoxy-1(2H)-naphthalenone; 7-Methoxy-1,2,3,4-tetrahydro-1-naphthalenone; 7-Methoxy-1,2,3,4-tetrahydro-1-oxonaphthalene; 7-Methoxy-3,4-dihydro-1(2H)-naphthalenone; 7-Methoxy-α-tetralone; 7-Methoxytetralin-1-one; 7-Methoxytetralone; NSC 97611

IUPAC Name

7-methoxy-3,4-dihydro-2H-naphthalen-1-one

Molecular Weight

176.21

Molecular Formula

C11H12O2

Canonical SMILES

COC1=CC2=C(CCCC2=O)C=C1

InChI

InChI=1S/C11H12O2/c1-13-9-6-5-8-3-2-4-11(12)10(8)7-9/h5-7H,2-4H2,1H3

InChIKey

GABLTKRIYDNDIN-UHFFFAOYSA-N

Boiling Point

140°C at 0.1 Torr

Melting Point

67-68°C

Purity

98.0%

Density

1.124±0.06 g/cm3

Solubility

Soluble in Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)

Appearance

Yellow to Brown Solid

Storage

Store at -20°C

MDL

MFCD00001696

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