Cyclopenta(de)naphthacene

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Basic information

CAS: 16683-64-0
Standard SMILES: C1=Cc2c3cc4ccccc4cc3cc3cccc1c23
InChIKey: PYSSVKADNGCTPT-UHFFFAOYSA-N
Molecular formula: C20H12
Average molar mass: 252.3 g/mol
Monoisotopic mass: 252.09390038

Names & identifiers

Preferred name: Cyclopenta(de)naphthacene
IUPAC: pentacyclo[11.6.1.02,11.04,9.017,20]icosa-1(20),2,4,6,8,10,12,14,16,18-decaene
English name: Benz(k)aceanthrylene
Molecular formula: C20H12
Molecular weight: 252.31

Names & synonyms

Cyclopenta(de)naphthaceneBenz(k)aceanthrylene16683-64-0CCRIS 2991BRN 4990771DTXSID80168197Benz[k]aceanthryleneRefChem:335856DTXCID9090688pentacyclo[11.6.1.02,11.04,9.017,20]icosa-1(20),2,4,6,8,10,12,14,16,18-decaeneCyclopenta[de]tetraceneSCHEMBL4848697

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Cyclopenta[de]naphthacene

Database identifiers

CAS: 16683-64-0
PubChem CID: 146307
DTXSID: DTXSID80168197
Nikkaji: J488.734D

Properties

Computed structural properties

XLogP: 6.2
Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 0
Heavy atoms: 20
Formal charge: 0
Complexity: 408

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Compound notes

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