Methyl 1-oxo-5-indanecarboxylate

Basic Information

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CAS Number

68634-02-6

Molecular Formula

C11H10O3

Molecular Weight

190.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

346.1°C at 760 mmHg

Density

1.243

SMILES

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

InChI

InChI=1S/C11H10O3/c1-14-11(13)8-2-4-9-7(6-8)3-5-10(9)12/h2,4,6H,3,5H2,1H3

InChIKey

YYKBHCRUMAMBPY-UHFFFAOYSA-N

LogP

1.6021

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

259

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

DS-3370
MFCD09263429
FT-0729325
CS-0150799
1-oxo-indan-5-carboxylic acid methyl ester
Methyl1-oxo-2,3-dihydro-1H-indene-5-carboxylate
SY117319
Methyl 1-oxo-2,3-dihydro-1H-indene-5-carboxylate
Methyl 1-oxo-2,3-dihydroindene-5-carboxylate
68634-02-6
DTXSID70438876
YYKBHCRUMAMBPY-UHFFFAOYSA-N
AKOS016009266
EN300-266459
Methyl 1-oxoindan-5-carboxylate
methyl 1-oxoindane-5-carboxylate
AM9412
SCHEMBL883773
1H-Indene-5-carboxylic acid, 2,3-dihydro-1-oxo-, methyl ester
methyl 1-oxo-2,3-dihydroindene-5-carboxylate
1-Oxo-indan-5-carboxylic acid methyl ester
Methyl 1-indanone-5-carboxylate
2,3-Dihydro-1-oxo-1H-indene-5-carboxylic acid methyl ester
Methyl 1-oxoindane-5-carboxylate
AK105863
AMOT0808
0596AC
FCH1158876
AX8239526
1H-IND

MDL Number

MFCD09263429

FAQ

What is Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6)?

Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6) is a derivative of an indane carboxylic acid with a methyl group attached to the 1-position and a carbonyl group at the 5-position. It is a colorless to light yellow liquid with a molecular weight of 194.23 and a boiling point of 238-240°C. This compound is used in various applications including pharmaceuticals and research.

What are the main uses of Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6)?

Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6) is primarily used as a precursor in the synthesis of other chemical compounds. It has applications in pharmaceuticals, where it is used in the development of new drugs, and in research, where it serves as a building block for organic synthesis.

Is Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6) safe?

Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6) is generally safe when handled with appropriate precautions. It is important to avoid skin contact and inhalation of vapors. Eye protection and gloves should be worn during handling. Proper ventilation is also necessary to prevent inhalation exposure.

How should Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6) be stored?

Methyl 1-oxo-5-indanecarboxylate (CAS: 68634-02-6) should be stored in a cool, dry place away from direct sunlight and heat sources. The container should be tightly sealed to prevent evaporation and contamination. It is recommended to store it at room temperature (15-25°C) and avoid temperatures above 30°C to maintain stability.