6-Bromo-3,4-dihydro-1(2H)-isoquinolinone

Basic Information

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CAS Number

147497-32-3

Molecular Formula

C9H8BrNO

Molecular Weight

226.07 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

453.3°C at 760 mmHg

SMILES

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C1CNC(=O)C2=C1C=C(C=C2)Br

InChI

InChI=1S/C9H8BrNO/c10-7-1-2-8-6(5-7)3-4-11-9(8)12/h1-2,5H,3-4H2,(H,11,12)

InChIKey

FQPKKECSRKYXIZ-UHFFFAOYSA-N

LogP

1.735

Topological Polar Surface Area

29.1 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

195

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

Synonyms & References

English

SY025396
FT-0649462
CHEMBL4565268
A808652
BDBM50503861
SCHEMBL581700
FQPKKECSRKYXIZ-UHFFFAOYSA-N
EN300-101833
6-BROMO-1-OXO-1,2,3,4-TETRAHYDROISOQUINOLINE
6-Bromo-3,4-dihydro-1(2H)-isoquinolinone
Z1192379518
147497-32-3
CS-D0456
MFCD04114858
6-bromo-1,2,3,4-tetrahydroisoquinolin-1-one
6-bromo-3,4-dihydroisoquinolin-1(2H)-one
AM20030004
PB27642
DTXSID10619066
6-Bromo-1-hydroxy-3,4-dihydroisoquinoline
1(2H)-ISOQUINOLINONE, 6-BROMO-3,4-DIHYDRO-
AKOS015900182
W-205660
BCP33712
FS-2432
BB 0260948
6-Bromo-3,4-dihydro-2H-isoquinolin-1-one
6-BROMO-3,4-DIHYDRO-1(1H)-ISOQUINOLINONE
6-Bromo-1, 2,3,4-tetrahydro isoquinolino-1-one
6-Bromo-3,4-dihydroisoquinolin-1(2H)-one
6-BROMO-3,4-1(1H)-ISOQUINOLINONE

MDL Number

MFCD04114858

Customs Code

2933790090

FAQ

What regulatory guidelines apply to 6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3)?

6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3) is subject to various regulatory guidelines. It falls under the GHS classification, which includes health, environmental, and physical hazards. For European markets, it must comply with the REACH regulations, ensuring that all necessary documentation is provided for safe handling and use. Additionally, it is regulated by the FDA and EPA for any potential use in pharmaceuticals or environmental applications.

Are there alternatives to 6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3) in synthesis?

While 6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3) is a valuable intermediate, several alternatives can be used depending on the desired outcome. Common reagents like 3,4-Dihydro-1(2H)-isoquinolinone or related brominated compounds may serve as substitutes. Isomers or analogs such as 6-Chloro-3,4-dihydro-1(2H)-isoquinolinone can also be considered for similar synthetic pathways.

What is the market or research trend for 6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3)?

The market for 6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3) is growing, driven by its applications in pharmaceuticals and research. Recent trends indicate increased interest in its use as a key intermediate in drug discovery and development. Research is focusing on its potential in treating various diseases, making it a sought-after compound in the scientific community.

How should waste containing 6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3) be handled?

Waste containing 6-Bromo-3,4-dihydro-1(2H)-isoquinolinone (CAS: 147497-32-3) should be managed carefully to ensure safety and compliance with environmental laws. Collect waste liquids in appropriate containers and store them in a well-ventilated area. For disposal, professional waste management services should be used. Incineration is a common method, but ensure it is done in a controlled environment to prevent environmental contamination. Always follow local regulations for hazardous waste management.