2-(4-Bromophenyl)-1,3-benzothiazole

Basic Information

View in Editor

CAS Number

19654-19-4

Molecular Formula

C13H8BrNS

Molecular Weight

290.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

132-136 °C

Boiling Point

398 ºC

Flash Point

194 ºC

Refractive Index

1.703

SMILES

View in Editor

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C13H8BrNS/c14-10-7-5-9(6-8-10)13-15-11-3-1-2-4-12(11)16-13/h1-8H

InChIKey

FQIRBKKYMJKENC-UHFFFAOYSA-N

LogP

4.725800000000002

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

240

Safety Information

View Safety Information

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

H413 May cause long lasting harmful effects to aquatic life
Hazardous to the aquatic environment, long-term hazard

Synonyms & References

English

A813858
MFCD00579199
NSC817072
AKOS000472898
J-012703
DTXSID20368073
AS-61256
2-(4-bromophenyl)benzthiazole
2-(4-bromophenyl)-1,3-benzothiazole
FQIRBKKYMJKENC-UHFFFAOYSA-N
Benzothiazole,2-(4-bromophenyl)-
2-(4-Bromophenyl)benzothiazole
AMY10388
2-(4-bromophenyl)-1,3-benzothiazole;2-(4-Bromophenyl)benzothiazole
CHEMBL1808312
1-(2-Benzothiazolyl)-4-bromobenzene
2-(4-Bromophenyl)benzothiazole, 97%
NSC-817072
2-(4-bromophenyl)benzo[d]thiazole
SCHEMBL4152344
19654-19-4
2-(4-Bromo-phenyl)-benzothiazole
BB 0256445
FT-0637884
B2679
F18751
AC-27911
Z50128963
CS-0065322
SCHEMBL1448988
SY046127

MDL Number

MFCD00579199

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4)?

2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4) is regulated by various guidelines, including GHS classification, REACH regulations, and FDA/EPA requirements. It is classified as a hazardous substance, and its transport and handling must comply with these guidelines to ensure safety and environmental protection.

Are there alternatives to 2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4) in synthesis?

In synthesis, 2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4) can be replaced by structurally similar compounds like 2-(4-Chlorophenyl)-1,3-benzothiazole or 2-(4-Iodophenyl)-1,3-benzothiazole. These alternatives can serve as effective substitutes in various reactions.

What is the market or research trend for 2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4)?

The market for 2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4) is growing due to its applications in pharmaceuticals and dyes. Research trends focus on its use in new drug development and as an intermediate in organic synthesis. Recent studies also explore its environmental impact and potential as a biocide.

How should waste containing 2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4) be handled?

Waste containing 2-(4-Bromophenyl)-1,3-benzothiazole (CAS: 19654-19-4) should be collected in appropriate containers and disposed of through incineration or professional waste disposal services. Environmental protection measures include ensuring proper handling to prevent contamination and adhering to all local and international waste disposal regulations.