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2-Nitrochrysene
[CAS# 3989-90-0]

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CAS#: 3989-90-0
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Identification
Name 2-Nitrochrysene
Synonyms Brn 5438027; Ccris 4949; Chrysene, 2-Nitro-
Molecular Structure CAS#: 3989-90-0, 2-Nitrochrysene
Molecular Formula C18H11NO2
Molecular Weight 273.29
CAS Registry Number 3989-90-0
SMILES C4=CC2=C(C=CC3=C1C=CC=CC1=CC=C23)C=C4[N+]([O-])=O
InChI 1S/C18H11NO2/c20-19(21)14-7-10-16-13(11-14)6-9-17-15-4-2-1-3-12(15)5-8-18(16)17/h1-11H
InChIKey HYNWUPUJMIJKMW-UHFFFAOYSA-N
Properties
Density 1.342g/cm3 (Cal.)
Boiling point 514.848°C at 760 mmHg (Cal.)
Flash point 258.76°C (Cal.)
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