CAS 273-13-2 2,1,3-Benzothiadiazole - Materials / Alfa Chemistry

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2,1,3-Benzothiadiazole

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Catalog Number

ACM273132

CAS Number

273-13-2

Product Name

2,1,3-Benzothiadiazole

Structure

Category

Small Molecule Semiconductor Building Blocks; Polymers

Synonyms

Piazthiole

IUPAC Name

2,1,3-benzothiadiazole

Molecular Weight

136.16999999999999

Molecular Formula

C6H4N2S

Canonical SMILES

C1=CC2=NSN=C2C=C1

InChI

InChI=1S/C6H4N2S/c1-2-4-6-5(3-1)7-9-8-6/h1-4H

InChI Key

PDQRQJVPEFGVRK-UHFFFAOYSA-N

Boiling Point

64 °C/1.5 mmHg

Melting Point

44 °C

Purity

>99.0%(GC)

Density

Air Sensitive

Appearance

White to Light yellow powder to crystal

Storage

Store under inert gas

Complexity

95.2

Covalently-Bonded Unit Count

EC Number

205-985-2

Exact Mass

136.009519g/mol

Formal Charge

Heavy Atom Count

Log P

1.98 (LogP)

MDL Number

MFCD00005809

MeSH Entry Terms

1,2,3-benzothiadiazole;2,1,3-benzothiadiazole;benzo-1,2,3-thiadiazole;benzothiadiazole

Monoisotopic Mass

136.009519g/mol

NSC Number

43636;679

Rotatable Bond Count

XLogP3

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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