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Benzo(h)pentaphene

HCID 123036
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Basic information

CAS
214-91-5
Standard SMILES
c1ccc2cc3c(cc2c1)c1ccccc1c1cc2ccccc2cc13
InChIKey
FUDUPLHPBBXJRW-UHFFFAOYSA-N
Molecular formula
C26H16
Average molar mass
328.4 g/mol
Monoisotopic mass
328.12520051

Names & identifiers

Preferred name
Benzo(h)pentaphene
IUPAC
hexacyclo[16.8.0.02,11.04,9.012,17.020,25]hexacosa-1(26),2,4,6,8,10,12,14,16,18,20,22,24-tridecaene

Names & synonyms

Benzo[h]pentapheneBenzo(h)pentaphene6,7-Benzopentaphene214-91-5Benzo(a)naphth(2,3-c)anthraceneDTXSID00175666RefChem:118248DTXCID3098157FUDUPLHPBBXJRW-UHFFFAOYSA-NSCHEMBL4855544

Database identifiers

CAS
214-91-5
PubChem CID
123036
DTXSID
DTXSID00175666
Nikkaji
J488.489B

Properties

Computed structural properties

XLogP
7.4
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
26
Formal charge
0
Complexity
462

Related reactions

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Compound notes

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