methyl 1H-indole-7-carboxylate

Basic Information

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CAS Number

93247-78-0

Molecular Formula

C10H9NO2

Molecular Weight

175.19 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

Basic Physical Properties

Melting Point

46-47 ºC

Boiling Point

331.7℃ at 760 mmHg

Density

1.253

Flash Point

154.4 °C

Refractive Index

1.639

SMILES

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COC(=O)C1=CC=CC2=C1NC=C2

InChI

InChI=1S/C10H9NO2/c1-13-10(12)8-4-2-3-7-5-6-11-9(7)8/h2-6,11H,1H3

InChIKey

FTLOEULOTNVCGF-UHFFFAOYSA-N

LogP

1.9545

Topological Polar Surface Area

42.09 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

205

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Methyl 1H-indole-7-carboxylate
1H-INDOLE-7-CARBOXYLIC ACID METHYL ESTER
Methyl indole-7-carboxylate
7-HEXADECYN-1-OL
7-Indolecarboxylic acid methyl este
INDOLE-7-CARBOXYLICACIDMETHYLESTER
Methyl 1H-indole-7-c
methyl 7-indolecarboxylate
METHYL(7-INDOLECARBOXYLATE) FOR SYNTHESIS
METHYL-1H-INDOLE-7-CARBOXYLATE
METHYL-INDOLE-7-CARBOXYLATE
RARECHEM AL BF 0640
Methyl1H-indole-7-carboxylate
Methyl 1H-indole-7-carboxylate (ACI)
Indole-7-carboxylic acid methyl ester
methyl 1H-indole-7-carboxylate
CC-0744
1H-Indole-7-carboxylic acid methyl ester
93247-78-0
MFCD00211064
EN300-132047
SCHEMBL761721
Z1201619795
DTXSID70918582
methyl indole-7-carboxylate, AldrichCPR
PB27475
STK833390
METHYL(7-INDOLECARBOXYLATE)
BCP26795
Methylindole-7-carboxylate
SDCCGMLS-0065886.P001

MDL Number

MFCD00211064

Customs Code

2933990090

FAQ

What regulatory guidelines apply to methyl 1H-indole-7-carboxylate (CAS: 93247-78-0)?

Methyl 1H-indole-7-carboxylate (CAS: 93247-78-0) falls under the scope of the REACH regulations in the European Union, which requires registration of substances above one tonne per year. In the United States, the FDA may require specific safety data and labeling, and the EPA may have reporting and handling requirements. Additionally, the GHS system classifies chemicals based on their hazards, which may include flammability, reactivity, and health effects.

Are there alternatives to methyl 1H-indole-7-carboxylate (CAS: 93247-78-0) in synthesis?

Alternative reagents such as ethyl 1H-indole-7-carboxylate and propyl 1H-indole-7-carboxylate can be used in synthesis depending on the desired product. Other analogs like methyl 1H-indole-6-carboxylate and methyl 1H-indole-8-carboxylate may also be considered. These alternatives offer similar functional groups and can be manipulated to achieve different molecular structures.

What is the market or research trend for methyl 1H-indole-7-carboxylate (CAS: 93247-78-0)?

Research on methyl 1H-indole-7-carboxylate (CAS: 93247-78-0) is driven by its potential applications in pharmaceuticals, agrochemicals, and fine chemicals. Market trends show a growing interest in its use as a building block for indole derivatives, which are valuable in drug discovery. Recent studies also focus on its environmental impact and sustainable synthesis methods.

How should waste containing methyl 1H-indole-7-carboxylate (CAS: 93247-78-0) be handled?

Waste containing methyl 1H-indole-7-carboxylate (CAS: 93247-78-0) should be collected in appropriate, labeled containers and stored under sealed conditions to prevent evaporation and contamination. Proper incineration or professional waste disposal services are recommended. Environmental protection measures include wearing appropriate personal protective equipment (PPE) and ensuring compliance with local waste disposal regulations to minimize environmental impact.