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About This Item
Empirical Formula (Hill Notation):
C18H12
CAS Number:
Molecular Weight:
228.29
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
200-280-6
Beilstein/REAXYS Number:
1909298
MDL number:
Assay:
99%
Form:
powder
InChI
1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H
SMILES string
c1ccc2cc3c(ccc4ccccc34)cc2c1
InChI key
DXBHBZVCASKNBY-UHFFFAOYSA-N
assay
99%
form
powder
bp
437.6 °C (lit.)
mp
157-159 °C (lit.)
Quality Level
Gene Information
human ... CYP1A2(1544)
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Related Categories
Application
Benz[a]anthracene can be used in the synthesis of other polycyclic aromatic hydrocarbons such as tribenzo[a,c,f]tetraphene.2 It can also be used for phosphorescence applications.
signalword
Danger
hcodes
Hazard Classifications
Aquatic Acute 1 - Aquatic Chronic 1 - Carc. 1B
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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Synthesis, Structural and Spectroscopic Characterization of Four [(η6?PAH) Cr (CO)3] Complexes (PAH= Pyrene, Perylene, Chrysene, 1, 2?Benzanthracene).
Arrais A, et al.
European Journal of Inorganic Chemistry, 2004(7), 1505-1513 (2004)
Crystal induced phosphorescence from Benz (a) anthracene microcrystals at room temperature.
Maity S, et al.
Spectrochimica Acta. Part A, Molecular and Biomolecular Spectroscopy, 157, 61-68 (2016)
Direct arylation of polycyclic aromatic hydrocarbons through palladium catalysis.
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Journal of the American Chemical Society, 133(28), 10716-10719 (2011)
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