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1-Nitro-3-Nitrosopyrene
[CAS# 144886-19-1]

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Identification
Name 1-Nitro-3-Nitrosopyrene
Synonyms 1-Nitro-3-Nitroso-Pyrene; Pyrene, 1-Nitro-3-Nitroso-
Molecular Structure CAS#: 144886-19-1, 1-Nitro-3-Nitrosopyrene
Molecular Formula C16H8N2O3
Molecular Weight 276.25
CAS Registry Number 144886-19-1
SMILES C2=C(N=O)C1=CC=C4C3=C1C(=C2[N+]([O-])=O)C=CC3=CC=C4
InChI 1S/C16H8N2O3/c19-17-13-8-14(18(20)21)12-7-5-10-3-1-2-9-4-6-11(13)16(12)15(9)10/h1-8H
InChIKey ORRRIEPKBDVTQB-UHFFFAOYSA-N
Properties
Density 1.506g/cm3 (Cal.)
Boiling point 504.529°C at 760 mmHg (Cal.)
Flash point 258.93°C (Cal.)
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