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1,3,7,9,10-Pentazatricyclo[6.3.0.02,6]undeca-2,4,6,8,10-pentaene

HCID 178802400
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Basic information

CAS
319929-16-3
Standard SMILES
C1=Cc2nc3nncn3c2=N1
InChIKey
VNUGAWGUFMDHQG-UHFFFAOYSA-N
Molecular formula
C6H3N5
Average molar mass
145.12 g/mol

Names & identifiers

Preferred name
1,3,7,9,10-Pentazatricyclo[6.3.0.02,6]undeca-2,4,6,8,10-pentaene
IUPAC
1,3,7,9,10-pentazatricyclo[6.3.0.02,6]undeca-2,4,6,8,10-pentaene
English name
Pyrrolo[3,2:4,5]imidazo[2,1-c]-1,2,4-triazole (9CI)
Molecular formula
C6H3N5
Molecular weight
145.12

Names & synonyms

Pyrrolo[3,2:4,5]imidazo[2,1-c]-1,2,4-triazole (9CI)

Database identifiers

CAS
319929-16-3

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
55.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
11
Formal charge
0
Complexity
289

Chemistry & industry

Suppliers1 total

CHEMSTEP[email protected]

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Compound notes

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