2-(Methylsulfanyl)-1,3-benzoxazole

Basic Information

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CAS Number

13673-62-6

Molecular Formula

C8H7NOS

Molecular Weight

165.22 g/mol

Basic Physical Properties

Boiling Point

122°C/8mmHg

Density

1.2370

Flash Point

119°C

Refractive Index

1.6120 to 1.6170

SMILES

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CSC1=NC2=CC=CC=C2O1

InChI

InChI=1S/C8H7NOS/c1-11-8-9-6-4-2-3-5-7(6)10-8/h2-5H,1H3

InChIKey

CBXAWZGFEDZKFR-UHFFFAOYSA-N

LogP

2.5497000000000005

Topological Polar Surface Area

26.03 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

142

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

Synonyms & References

English

AKOS006242244
CS-W021447
2-methylthio-1-H-benzoxazole
2-METHYLTHIO BENZOXAZOLE
CBXAWZGFEDZKFR-UHFFFAOYSA-N
13673-62-6
2-methylmercaptobenzoxazole
2-(Methylthio)benzo[d]oxazole
2-(methylthio)-1,3-benzoxazole
FT-0602035
2-(Methylthio)benzoxazole
SCHEMBL303847
A807120
FT-0652759
2-methylsulfanyl-benzooxazole
CHEMBL4247662
SCHEMBL9545455
2-methylsulfanyl-1,3-benzoxazole
Benzoxazole, 2-(methylthio)-
2-methylmercapto-benzoxazole
MFCD00160027
2-(METHYLSULFANYL)-1,3-BENZOXAZOLE
FS-3713
2-methylsulfanyl-1,3-benzoxazole;2-(Methylthio)benzo[d]oxazole
M2454
DTXSID50400339
DS-2598
2-Methylthiobenzoxazole
7004 2-METHYLTHIOBENZOXAZOLE
2-Methylthio Benzoxazole
2-METHYLTHIO BENZOXAZOLE 99%

MDL Number

MFCD00160027

Customs Code

2934999090

FAQ

What is 2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6)?

2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6) is a heterocyclic organic compound with the molecular formula C8H8NO2S. It is a benzoxazole derivative with a methylthio substituent on the benzene ring. This compound exhibits unique chemical properties, including its stability and ability to form complexes with various metal ions.

What are the main uses of 2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6)?

2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6) is primarily used as a precursor in the synthesis of other organic compounds and in the development of novel materials. It has applications in pharmaceuticals, specifically in drug synthesis, and as a reagent in organic chemistry research.

Is 2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6) safe?

2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6) is generally considered safe under normal handling conditions. However, it should be used with caution due to its potential irritant properties. Proper ventilation and personal protective equipment (PPE) such as gloves and goggles are recommended to minimize exposure. Avoid inhalation and contact with skin and eyes.

How should 2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6) be stored?

2-(Methylsulfanyl)-1,3-benzoxazole (CAS: 13673-62-6) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. Store it at room temperature or slightly below, avoiding temperatures above 30°C to ensure optimal stability and safety.