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Naphtho[2,3-j]fluoranthene

HCID 6428083
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Basic information

CAS
205-83-4
Standard SMILES
c1ccc2cc3c4c(ccc3cc2c1)-c1cccc2cccc-4c12
InChIKey
ZQYVVUIWXIUAKD-UHFFFAOYSA-N
Molecular formula
C24H14
Average molar mass
302.4 g/mol
Monoisotopic mass
302.10955045

Names & identifiers

Preferred name
Naphtho[2,3-j]fluoranthene
IUPAC
hexacyclo[14.7.1.02,15.03,12.05,10.020,24]tetracosa-1(23),2(15),3,5,7,9,11,13,16,18,20(24),21-dodecaene
English name
Naphtho[2,3-j]fluoranthene
Molecular formula
C24H14
Molecular weight
302.37

Names & synonyms

Naphtho[2,3-j]fluoranthene205-83-4Naphtho(2,3-j)fluorantheneacenaphth[1,2-a]anthraceneAcenaphth(1,2-a)anthraceneNaphtho(2',3':7,8)fluorantheneDTXSID90174481RefChem:164746DTXCID6096972ZQYVVUIWXIUAKD-UHFFFAOYSA-Nhexacyclo[14.7.1.02,15.03,12.05,10.020,24]tetracosa-1(23),2(15),3,5,7,9,11,13,16,18,20(24),21-dodecaeneNaphto[2,3-j]fluoranthene
Show more names
SCHEMBL4852044Acenaphth[1,2-alpha]anthraceneNS00127310

Database identifiers

CAS
205-83-4
PubChem CID
6428083
DTXSID
DTXSID90174481
Nikkaji
J1.864.902K

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
24
Formal charge
0
Complexity
480

Physicochemical properties

Melting point
225.5 · 225.5-227.5 °C
Boiling point
552.3 · 552.3±17.0 °C(Predicted)
Density
1.313 · 1.313±0.06 g/cm3(Predicted)

Chemistry & industry

Applications

UsesAcenaphth[1,2-a]anthracene is mutagenic. It is a ubiquitous pollutant in urban air that may pose risks to human health. It is also used as a standard in determination of polycyclic aromatic hydrocarbons (PAH’s).

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