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2,1,3-Benzoxadiazole-4-carboxaldehyde

Catalog Number
ACM32863324-1
CAS Number
32863-32-4
Product Name
2,1,3-Benzoxadiazole-4-carboxaldehyde
Structure
Category
Small Molecule Semiconductor Building Blocks; Semiconductor Blocks
Synonyms
4-Benzofurazancarboxaldehyde
IUPAC Name
2,1,3-benzoxadiazole-4-carbaldehyde
Molecular Weight
148.12
Molecular Formula
C7H4N2O2
Canonical SMILES
C1=CC2=NON=C2C(=C1)C=O
InChI
InChI=1S/C7H4N2O2/c10-4-5-2-1-3-6-7(5)9-11-8-6/h1-4H
InChI Key
YBBRQAXNTWMMFZ-UHFFFAOYSA-N
Melting Point
108 °C
Purity
>98.0%(GC)
Density
Air Sensitive
Appearance
Light orange to Yellow to Green powder to crystal
Storage
Store under inert gas,0-10°C
Complexity
163
Covalently-Bonded Unit Count
1
Exact Mass
148.027277g/mol
Formal Charge
0
Heavy Atom Count
11
MDL Number
MFCD07772900
Monoisotopic Mass
148.027277g/mol
Rotatable Bond Count
1
XLogP3
0.6
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