7-Bromo-1H-indole-3-carboxylic acid

Basic Information

View in Editor

CAS Number

86153-25-5

Molecular Formula

C9H6BrNO2

Molecular Weight

240.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Pale-yellow to Yellow-brown Solid

Boiling Point

470.9℃ at 760 mmHg

Density

1.838

Flash Point

238.6°C

Refractive Index

1.749

SMILES

View in Editor

C1=CC2=C(C(=C1)Br)NC=C2C(=O)O

InChI

InChI=1S/C9H6BrNO2/c10-7-3-1-2-5-6(9(12)13)4-11-8(5)7/h1-4,11H,(H,12,13)

InChIKey

RMWZYIREGHRJOQ-UHFFFAOYSA-N

LogP

2.6286000000000005

Topological Polar Surface Area

53.089999999999996 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

222

Safety Information

View Safety Information

GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

AS-38022
DTXSID50647520
Z1143220556
7-bromoindole-3-carboxylicacid
AMY24377
1H-Indole-3-carboxylic acid, 7-bromo-
MFCD07369966
CS-0130495
SCHEMBL3762044
86153-25-5
AKOS015898365
7-bromoindole-3-carboxylic acid
7-bromo-1H-indole-3-carboxylic acid
SB13942
AC-9215
J-519107
EN300-253339
FT-0602629
SY023120
RMWZYIREGHRJOQ-UHFFFAOYSA-N
7-Bromo-1H-indole-3-carboxylic acid
1H-INDOLE-3-CARBOXYLIC ACID,7-BROMO-
1H-Indole-3-carboxylicacid, 7-bromo-
7-Bromo-1H-indole-3-carboxylicacid
VI30348
ST2419024
AB0007610
W8851

MDL Number

MFCD07369966

Customs Code

2933990090

FAQ

What regulatory guidelines apply to 7-Bromo-1H-indole-3-carboxylic acid (CAS: 86153-25-5)?

7-Bromo-1H-indole-3-carboxylic acid (CAS: 86153-25-5) falls under the scope of the REACH regulation in the European Union and the TSCA in the United States. It is also subject to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) for proper hazard communication. In the context of pharmaceuticals, it must comply with FDA regulations regarding chemical structure and toxicity. For environmental protection, it should be managed according to EPA guidelines to prevent contamination.

Are there alternatives to 7-Bromo-1H-indole-3-carboxylic acid (CAS: 86153-25-5) in synthesis?

Alternative reagents for synthesis include 7-iodo-1H-indole-3-carboxylic acid, 7-chloro-1H-indole-3-carboxylic acid, and 7-fluoro-1H-indole-3-carboxylic acid. These bromo-substituted analogs can be used as synthetic equivalents. Additionally, other indole derivatives such as 1H-indole-3-carboxylic acid can serve as useful alternatives depending on the desired properties and reactivity.

What is the market or research trend for 7-Bromo-1H-indole-3-carboxylic acid (CAS: 86153-25-5)?

The market trend for 7-Bromo-1H-indole-3-carboxylic acid (CAS: 86153-25-5) is driven by its use in pharmaceuticals and research, particularly in the development of bioactive compounds and drug candidates. Recent research focuses on its potential as a scaffold for new drug discovery. Market trends indicate a steady demand with increasing interest in its application for therapeutic purposes.

How should waste containing 7-Bromo-1H-indole-3-carboxylic acid (CAS: 86153-25-5) be handled?

Waste containing 7-Bromo-1H-indole-3-carboxylic acid (CAS: 86153-25-5) should be collected in appropriate containers and stored in a secure area. It should be treated as a hazardous waste and disposed of through a professional chemical waste disposal service. Environmental precautions include neutralizing any residual bromine compounds and ensuring the waste is not released into the environment. Compliance with local and international regulations for chemical waste disposal is crucial.