[1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione

Basic Information

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CAS Number

53052-06-5

Molecular Formula

C6H4N2OS

Molecular Weight

152.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

243-246 °C

Boiling Point

284.1°C at 760 mmHg

Density

1.402 (estimate)

Refractive Index

1.6430 (estimate)

SMILES

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C1=CC2=C(NC(=S)O2)N=C1

InChI

InChI=1S/C6H4N2OS/c10-6-8-5-4(9-6)2-1-3-7-5/h1-3H,(H,7,8,10)

InChIKey

BRSZJWYJYOGBGK-UHFFFAOYSA-N

LogP

1.5114999999999998

Topological Polar Surface Area

38.92 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

162

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

2-mercaptooxazolo[4,5-b]pyridine
Oxazolo[4,5-b]pyridine-2(3H)-thione
1,3-Oxazolo[4,5-b]pyridine-2-thiol
53052-06-5
DTXSID00993241
OXAZOLO[4,5-B]PYRIDIN-2(3H)THIONE
211949-57-4
HMS2437N13
SY086794
J-523853
Z1201620735
OXAZOLO[4,5-B]PYRIDINE-2-THIOL
FT-0709899
AMY16395
SCHEMBL218622
Oxazolo[4,5-b]pyridin-2(3H)-thione
CHEMBL1427056
EN300-213689
[1,3]OXAZOLO[4,5-B]PYRIDIN-2-YLHYDROSULFIDE
SMR000036930
A829367
AKOS005070679
1,3-Oxazolo[4,5-b]pyridin-2(3h)thione
CS-0043975
7243-02-9
5Y-0203
FT-0680483
3-O-TOLYLAMINO-PROPIONICACID
E75908
BRSZJWYJYOGBGK-UHFFFAOYSA-N
[1,3]oxazolo[4,5-b]pyridine-2-thiol

MDL Number

MFCD00973914

FAQ

What regulatory guidelines apply to [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione (CAS: 53052-06-5)?

The regulatory guidelines applicable to [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione (CAS: 53052-06-5) include the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations, and FDA/EPA requirements. This compound is classified as an organic compound and is subject to hazard communication standards, registration requirements, and environmental protection laws.

Are there alternatives to [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione in synthesis?

There are several alternatives to [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione in synthesis, including other thiones and related heterocycles. Common alternative reagents include thiols, thioacetals, and other heterocyclic compounds that can serve similar functions in various chemical reactions.

What is the market or research trend for [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione?

The market and research trends for [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione show increasing interest in its use as a building block for drug discovery and synthesis of functional materials. Recent research focuses on its potential in catalysis, medicinal chemistry, and as a precursor in organic synthesis.

How should waste containing [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione be handled?

Waste containing [1,3]Oxazolo[4,5-b]pyridine-2(3H)-thione should be collected and incinerated in a controlled environment, or disposed of through professional waste disposal services. Follow local environmental regulations and ensure proper handling to minimize environmental impact and comply with safety standards.