Benzo[f]cinnoline

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Basic information

CAS: 23992-63-4
Standard SMILES: c1ccc2c(c1)ccc1nnccc12
InChIKey: FCEUOTOBJMBWHC-UHFFFAOYSA-N
Molecular formula: C12H8N2
Average molar mass: 180.2 g/mol
Monoisotopic mass: 180.06874826

Names & identifiers

Preferred name: Benzo[f]cinnoline
IUPAC: benzo[f]cinnoline

Names & synonyms

Benzo[f]cinnoline23992-63-4diazaphenanthreneSCHEMBL406931SCHEMBL535730SCHEMBL17511863SCHEMBL17511875SCHEMBL17511890SCHEMBL17511971SCHEMBL17511972SCHEMBL29522531SCHEMBL30547075

Show more names

DTXSID10621503

Database identifiers

CAS: 23992-63-4
PubChem CID: 22014990
DTXSID: DTXSID10621503
Nikkaji: J2.952.000C

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 25.8 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 14
Formal charge: 0
Complexity: 204

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Compound notes

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