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4,5,8,9-Tetrazatetracyclo[4.4.0.02,10.03,7]decane

HCID 178768071
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Basic information

CAS
123994-27-4
Standard SMILES
N1NC2C3C4NNC(C14)C23
InChIKey
HHQNAYKTTOFYPB-UHFFFAOYSA-N
Molecular formula
C6H10N4
Average molar mass
138.17 g/mol

Names & identifiers

Preferred name
4,5,8,9-Tetrazatetracyclo[4.4.0.02,10.03,7]decane
IUPAC
4,5,8,9-tetrazatetracyclo[4.4.0.02,10.03,7]decane
English name
3,6,7-Metheno-1H-pyrazolo[4,3-c]pyridazine,octahydro-(9CI)
Molecular formula
C6H10N4
Molecular weight
138.1704

Names & synonyms

3,6,7-Metheno-1H-pyrazolo[4,3-c]pyridazine,octahydro-(9CI)

Database identifiers

CAS
123994-27-4

Properties

Computed structural properties

XLogP
-1.2
Topological polar surface area
48.1 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
10
Formal charge
0
Complexity
188

Chemistry & industry

Suppliers1 total

CHEMSTEP[email protected]

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Compound notes

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