Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate

Basic Information

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CAS Number

658082-39-4

Molecular Formula

C11H9NO3

Molecular Weight

203.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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COC(=O)C1=CC2=C(C=C1)C=CNC2=O

InChI

InChI=1S/C11H9NO3/c1-15-11(14)8-3-2-7-4-5-12-10(13)9(7)6-8/h2-6H,1H3,(H,12,13)

InChIKey

XPAAMEMUBWBMIK-UHFFFAOYSA-N

LogP

1.3146999999999998

Topological Polar Surface Area

59.16 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

311

Synonyms & References

English

Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate
methyl 1,2-dihydro-1-oxo-7-Isoquinolinecarboxylate
7-Isoquinolinecarboxylic acid, 1,2-dihydro-1-oxo-, methyl ester
methyl 1-oxo-2H-isoquinoline-7-carboxylate
XPAAMEMUBWBMIK-UHFFFAOYSA-N
658082-39-4
AS-50303
AB73876
1-oxo-1,2-dihydroisoquinoline-7-carboxylic acid methyl ester
MFCD18250896
SCHEMBL2116289
METHYL 1-OXO-2H-ISOQUINOLINE-7-CARBOXYLATE
SCHEMBL9106372
SY119883
AMY10023
methyl 1-hydroxyisoquinoline-7-carboxylate
CS-0150778
methyl 1-oxo-1,2-dihydroisoquinoline-7carboxylate
Methyl1-oxo-1,2-dihydroisoquinoline-7-carboxylate
DTXSID30733591
O11843
AKOS016000975

MDL Number

MFCD18250896

FAQ

What is Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate (CAS: 658082-39-4)?

Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate (CAS: 658082-39-4) is an organic compound with the molecular formula C12H11NO4. It is characterized by its aromatic structure and contains a carboxyl group. This compound is commonly used in pharmaceutical research as a precursor for drug development.

What are the main uses of Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate (CAS: 658082-39-4)?

Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate is primarily used in pharmaceutical research for developing new drugs. It serves as a key intermediate in the synthesis of various bioactive compounds with potential therapeutic applications.

Is Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate (CAS: 658082-39-4) safe?

Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate (CAS: 658082-39-4) is generally considered safe for laboratory use when handled with appropriate precautions. Users should wear appropriate personal protective equipment, such as gloves and goggles, and ensure the compound is stored in a well-ventilated area. Proper disposal should be followed to minimize environmental impact.

How should Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate (CAS: 658082-39-4) be stored?

Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate (CAS: 658082-39-4) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to protect it from moisture and air. The storage temperature should be maintained between 15-25°C (59-77°F) to ensure its stability and integrity.