2-Bromo-5-isopropylthiazole

Basic Information

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CAS Number

1159817-16-9

Molecular Formula

C6H8BrNS

Molecular Weight

206.11 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

SMILES

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CC(C)C1=CN=C(S1)Br

InChI

InChI=1S/C6H8BrNS/c1-4(2)5-3-8-6(7)9-5/h3-4H,1-2H3

InChIKey

NUQPBEKNGDTVLD-UHFFFAOYSA-N

LogP

3.0290000000000017

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

97.1

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

2-Bromo-5-isopropylthiazole
2-bromanyl-5-propan-2-yl-1,3-thiazole
2-bromo-5-(propan-2-yl)-1,3-thiazole
AK-64571
KB-229005
MolPort-021-797-187
QC-6426
RP07204
SureCN2628925
2-BroMo-5-(isopropyl) thiazole
2-bromo-5-(iso-propyl)thiazole
NUQPBEKNGDTVLD-UHFFFAOYSA-N
STL555494
BBL101698
Thiazole, 2-bromo-5-(1-methylethyl)-
AB0039638
Y7137
ST24022074
W-204873
DB-338213
AKOS007930387
2-bromo-5-propan-2-yl-1,3-thiazole
EN300-127677
1159817-16-9
SCHEMBL2628925
J-508387
DTXSID60671775
2-BROMO-5-ISOPROPYL THIAZOLE
DS-15594
CS-W005707
A893723

MDL Number

MFCD12033480

FAQ

What regulatory guidelines apply to 2-Bromo-5-isopropylthiazole (CAS: 1159817-16-9)?

2-Bromo-5-isopropylthiazole (CAS: 1159817-16-9) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), which includes restrictions on handling, storage, and disposal. In the European Union, it is subject to the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) regulations. Additionally, the U.S. Food and Drug Administration (FDA) and the Environmental Protection Agency (EPA) have specific guidelines for the use and disposal of this compound in pharmaceutical and industrial applications.

Are there alternatives to 2-Bromo-5-isopropylthiazole (CAS: 1159817-16-9) in synthesis?

For synthesizing similar functionalities, alternatives such as 2-iodo-5-isopropylthiazole and 2-chloro-5-isopropylthiazole can be considered. These alternatives may offer similar reactivity but with different bromine substituents, providing flexibility in synthetic approaches. Additionally, isothiazoles with different substituents on the thiazole ring, such as 5-tert-butylthiazole, can serve as useful analogs.

What is the market or research trend for 2-Bromo-5-isopropylthiazole (CAS: 1159817-16-9)?

The market for 2-Bromo-5-isopropylthiazole (CAS: 1159817-16-9) is growing due to its applications in pharmaceuticals and agrochemicals. Research trends indicate increasing interest in its use as an intermediate in the synthesis of bioactive compounds and as a potential herbicide. Recent studies focus on optimizing synthesis methods and exploring its properties for various applications, driven by rising demand in these sectors.

How should waste containing 2-Bromo-5-isopropylthiazole (CAS: 1159817-16-9) be handled?

Waste containing 2-Bromo-5-isopropylthiazole (CAS: 1159817-16-9) should be collected in appropriate containers and stored in a well-ventilated area away from direct sunlight and sources of ignition. For disposal, incineration is a common method, but professional waste disposal services should be used to ensure compliance with environmental regulations. Proper labeling and documentation of waste are essential to meet regulatory requirements and minimize environmental impact.