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1,2,4,5-Tetracyanobenzene

Catalog Number
ACM712743-1
CAS Number
712-74-3
Product Name
1,2,4,5-Tetracyanobenzene
Structure
Category
Phthalonitriles & Naphthalonitriles; Phthalocyanine Building Blocks
Synonyms
1,2,4,5-Benzenetetracarbonitrile, Pyromellitic acid tetranitrile
IUPAC Name
benzene-1,2,4,5-tetracarbonitrile
Molecular Weight
178.15
Molecular Formula
C10H2N4
Canonical SMILES
C1=C(C(=CC(=C1C#N)C#N)C#N)C#N
InChI
InChI=1S/C10H2N4/c11-3-7-1-8(4-12)10(6-14)2-9(7)5-13/h1-2H
InChI Key
FAAXSAZENACQBT-UHFFFAOYSA-N
Melting Point
265-268 °C-lit.
Purity
98%
Appearance
White solid powder
Complexity
332
Covalently-Bonded Unit Count
1
Exact Mass
178.027946g/mol
Formal Charge
0
Heavy Atom Count
14
MeSH Entry Terms
1,2,4,5-tetracyanobenzene;p-dicyanobenzene;tetracyanobenzene
Monoisotopic Mass
178.027946g/mol
Rotatable Bond Count
0
XLogP3
0.8
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