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6-Nitrobenz(a)Pyrene
[CAS# 63041-90-7]

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Identification
Classification Analytical chemistry >> Standard >> Volatile organic compounds (VOCs)
Name 6-Nitrobenz(a)Pyrene
Synonyms 6-Nitrobenz(A)Pyrene; Brn 2472924; Bcr311_Fluka
Molecular Structure CAS#: 63041-90-7, 6-Nitrobenz(a)Pyrene
Molecular Formula C20H11NO2
Molecular Weight 297.31
CAS Registry Number 63041-90-7
SMILES C2=CC1=CC=CC5=C1C3=C(C(=C4C(=C23)C=CC=C4)[N+](=O)[O-])C=C5
InChI 1S/C20H11NO2/c22-21(23)20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-11H
InChIKey NMMAFYSZGOFZCM-UHFFFAOYSA-N
Properties
Density 1.43g/cm3 (Cal.)
Boiling point 524.096°C at 760 mmHg (Cal.)
Flash point 259.496°C (Cal.)
References
(1) Matteo Carrara and Reinhard Niessner. Impact of a NO-regenerated diesel particulate filter on PAH and NPAH emissions from an EURO IV heavy duty engine, J. Environ. Monit., 2011, 13, 3373.
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