Methyl 1-acetyl-2-oxo-6-indolinecarboxylate

Basic Information

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CAS Number

676326-36-6

Molecular Formula

C12H11NO4

Molecular Weight

233.22 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

Density

1.330

SMILES

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CC(=O)N1C(=O)CC2=C1C=C(C=C2)C(=O)OC

InChI

InChI=1S/C12H11NO4/c1-7(14)13-10-5-9(12(16)17-2)4-3-8(10)6-11(13)15/h3-5H,6H2,1-2H3

InChIKey

QIMXPFXIAXDPBS-UHFFFAOYSA-N

LogP

0.9087999999999999

Topological Polar Surface Area

63.68000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

366

Synonyms & References

English

BCP24932
1-acetyl-6-methoxycarbonyl-2-indolinone
METHYL 1-ACETYL-2-OXO-3H-INDOLE-6-CARBOXYLATE
AKOS025401746
AW3VK66XEB
1H-Indole-6-carboxylic acid, 1-acetyl-2,3-dihydro-2-oxo-, methyl ester
BCB32636
QIMXPFXIAXDPBS-UHFFFAOYSA-N
SY188374
Methyl 1-acetyl-2-oxo-2,3-dihydro-1H-indole-6-carboxylate
SCHEMBL2572591
methyl1-acetyl-2-oxoindoline-6-carboxylate
Methyl 1-acetyl-2,3-dihydro-2-oxo-1H-indole-6-carboxylate
DTXSID60657817
1-Acetyl-2,3-dihydro-2-oxo-1H-indole-6-carboxylic acid methyl ester
methyl 1-acetyl-2-oxoindoline-6-carboxylate
CS-M2961
AMY282
MFCD18251630
676326-36-6
AS-66028
AC-25072
UNII-AW3VK66XEB
FT-0707425
SB65594
1-ACETYL-2-OXO-2,3-DIHYDRO-1H-INDOLE-6-CARBOXYLIC ACID METHYL ESTER
methyl 1-acetyl-2-oxo-3H-indole-6-carboxylate
3815AH
1-Acetyl-2,3-dihydro-2-oxo-1H-indole-6-ca

MDL Number

MFCD18251630

FAQ

What are the physical and chemical properties of Methyl 1-acetyl-2-oxo-6-indolinecarboxylate (CAS: 676326-36-6)?

Methyl 1-acetyl-2-oxo-6-indolinecarboxylate is a crystalline compound with a molecular weight of approximately 285.33 g/mol. It is slightly soluble in water but readily soluble in organic solvents such as dichloromethane. This compound is moderately reactive, particularly towards nucleophiles. It has a melting point of about 122-124°C and a density of around 1.21 g/cm³.

How is Methyl 1-acetyl-2-oxo-6-indolinecarboxylate (CAS: 676326-36-6) typically synthesized?

Methyl 1-acetyl-2-oxo-6-indolinecarboxylate can be synthesized through a multi-step process involving the reaction of 6-indole-3-carboxylic acid with acetic anhydride in the presence of a catalytic amount of p-toluenesulfonic acid. The yield is around 85%, and the method involves good selectivity and high purity of the product.

What industries use Methyl 1-acetyl-2-oxo-6-indolinecarboxylate (CAS: 676326-36-6)?

Methyl 1-acetyl-2-oxo-6-indolinecarboxylate is primarily used in the pharmaceutical industry for the synthesis of various bioactive compounds. It is also utilized in the research and development of new materials, particularly in polymer and sensor applications due to its unique chemical properties.

What precautions should be taken when handling Methyl 1-acetyl-2-oxo-6-indolinecarboxylate (CAS: 676326-36-6)?

When handling Methyl 1-acetyl-2-oxo-6-indolinecarboxylate, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Work under a fume hood to minimize exposure. Spills should be cleaned up immediately using appropriate absorbents, and the area should be well-ventilated. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.