3-Chloro-1-benzothiophene

Basic Information

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CAS Number

7342-86-1

Molecular Formula

C8H5ClS

Molecular Weight

168.65 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

261.5°C at 760 mmHg

SMILES

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C1=CC=C2C(=C1)C(=CS2)Cl

InChI

InChI=1S/C8H5ClS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5H

InChIKey

VURMGNDSRHGHQN-UHFFFAOYSA-N

LogP

3.5547000000000013

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

126

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

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

Synonyms & References

English

BS-24385
NSC-60757
SE587G4DK7
3-Chloro-1-benzothiophene
Benzo(b)thiophene, 3-chloro-
Benzo[b]thiophene, 3-chloro-
SCHEMBL546825
Benzo(b)thiophene, 3(?)-chloro-
InChI=1/C8H5ClS/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5
3-chlorobenzo[b]thiophene
UNII-SE587G4DK7
3-CHLOROBENZO(B)THIOPHENE
3-Chlorobenzothiophene
DTXSID40223655
NSC 60757
3-chloro-benzo[b]thiophene
A909718
CS-0204746
7342-86-1
EN300-243554
NSC60757
AKOS006291612
AI3-18362
3-CHLORO-1-BENZOTHIOPHENE
3-Chlor-benzo[b]thiophen
3-Chlor-benzo< b> thiophen
3-Chlorobenzo< b> thiophen
3-chlorobenzo< b> thiophene
3-Chloro-benzothiophene
AC1Q3LH6
AG-G-90458

MDL Number

MFCD08361765

FAQ

What regulatory guidelines apply to 3-Chloro-1-benzothiophene (CAS: 7342-86-1)?

3-Chloro-1-benzothiophene (CAS: 7342-86-1) is classified as a hazardous chemical under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and is subject to REACH regulations in the European Union. In the USA, it is regulated by the EPA and FDA. Specific handling, storage, and disposal requirements must be followed according to local and international regulations.

Are there alternatives to 3-Chloro-1-benzothiophene (CAS: 7342-86-1) in synthesis?

Synthetic alternatives to 3-Chloro-1-benzothiophene (CAS: 7342-86-1) include 2-Chloro-1-benzothiophene and 4-Chloro-1-benzothiophene, which can be used in similar applications. Other substitutes include 1-benzothiophene and 3-bromo-1-benzothiophene, depending on the specific requirements of the synthesis process.

What is the market or research trend for 3-Chloro-1-benzothiophene (CAS: 7342-86-1)?

The market for 3-Chloro-1-benzothiophene (CAS: 7342-86-1) is primarily driven by its use in pharmaceuticals, particularly in the synthesis of antipsychotic drugs and other medicinal compounds. Research trends are focusing on its application in new drug discovery and development, with ongoing studies exploring its potential in treating neurological disorders.

How should waste containing 3-Chloro-1-benzothiophene (CAS: 7342-86-1) be handled?

Waste containing 3-Chloro-1-benzothiophene (CAS: 7342-86-1) should be collected and stored in appropriate containers to prevent leaks or spills. The waste should be disposed of through incineration or professional waste disposal services that comply with local and international environmental regulations. Proper protection against skin contact and inhalation is essential during handling and disposal processes.