Structure

Benzothiazole

CAS
95-16-9
Catalog Number
ACM95169
Category
Other Products
Molecular Weight
135.19
Molecular Formula
C7H5NS

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Specification

Synonyms
1,3-BENZOTHIAZOLE;LABOTEST-BB LT01409601;FEMA NUMBER 3256;FEMA 3256;BENZOTHIAZOLE;1-Thia-3-azaindene;Benzosulfonazole;Benzothiazol
Boiling Point
231°C(lit.)
Melting Point
2°C
Flash Point
96.6°C
Density
1.238
Appearance
Yellow liquid with an unpleasant odour
Assay
0.9999
Hazard Statements
Xn,T,Xi
Packaging
1 kg
Refractive Index
1.641-1.644
Safety Description
23-26-36-36/37-45
Stability
Stable - regarded as highly persistent in the environment. Incompatible with strong oxidizing agents. Combustion products: nitrogen oxides, carbon monoxide, carbon dioxide, sulphur oxides.
Storage Conditions
Keep away from heat and flame. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep away from water.
Supplemental Hazard Statements
H302-H311-H320-H402-H301-H301+H311-H319-H332
Symbol
GHS06
What is the molecular formula of benzothiazole?

The molecular formula of benzothiazole is C7H5NS.

What is the molecular weight of benzothiazole?

The molecular weight of benzothiazole is 135.19 g/mol.

What is the IUPAC name of benzothiazole?

The IUPAC name of benzothiazole is 1,3-benzothiazole.

What is the InChI of benzothiazole?

The InChI of benzothiazole is InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H.

What is the InChIKey of benzothiazole?

The InChIKey of benzothiazole is IOJUPLGTWVMSFF-UHFFFAOYSA-N.

What is the canonical SMILES of benzothiazole?

The canonical SMILES of benzothiazole is C1=CC=C2C(=C1)N=CS2.

What is the CAS number of benzothiazole?

The CAS number of benzothiazole is 95-16-9.

What is the ChEMBL ID of benzothiazole?

The ChEMBL ID of benzothiazole is CHEMBL510309.

What is the FEMA number of benzothiazole?

The FEMA number of benzothiazole is 3256.

What is the Wikipedia entry for benzothiazole?

The Wikipedia entry for benzothiazole is Benzothiazole.

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