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1,3-Diiminobenz[f]isoindoline

Catalog Number
ACM65558692-1
CAS Number
65558-69-2
Product Name
1,3-Diiminobenz[f]isoindoline
Structure
Category
Phthalonitriles & Naphthalonitriles; Phthalocyanine Building Blocks
IUPAC Name
3-iminobenzo[f]isoindol-1-amine
Molecular Weight
195.22g/mol
Molecular Formula
C12H9N3
Canonical SMILES
C1=CC=C2C=C3C(=CC2=C1)C(=NC3=N)N
InChI
InChI=1S/C12H9N3/c13-11-9-5-7-3-1-2-4-8(7)6-10(9)12(14)15-11/h1-6H,(H3,13,14,15)
InChI Key
JAWNWEKHDFBPSG-UHFFFAOYSA-N
Complexity
321
Covalently-Bonded Unit Count
1
Exact Mass
195.079647g/mol
Formal Charge
0
Heavy Atom Count
15
Monoisotopic Mass
195.079647g/mol
Rotatable Bond Count
0
UNII
W6B17HR0NG
XLogP3
1.7
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