NAVIGATION


2,1,3-Benzothiadiazole

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
1
EC Number
205-985-2
Exact Mass
136.009519g/mol
Formal Charge
0
Heavy Atom Count
9
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
0
XLogP3
2
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