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Basic Information
CAS No.: 2304-85-0
Name: pyrene-1,8-dione
Molecular Structure:
Molecular Structure of 2304-85-0 (pyrene-1,8-dione)
Formula: C16H8 O2
Molecular Weight: 232.238
Synonyms: 1,8-Pyrenequinone;3,10-Pyrenedione; 3,10-Pyrenequinone; 3,6-Pyrenedione; 3,6-Pyrenequinone
Density: 1.439g/cm3
Boiling Point: 479.2°Cat760mmHg
Flash Point: 177.8°C
Safety: Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
PSA: 34.14000
LogP: 3.25880
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Chemistry

Chemistry informtion about 1,8-Pyrenedione(CAS NO.2304-85-0) is:
IUPAC Name: pyrene-1,8-dione
Synonyms: pyrene-1,8-dione ; BRN 1963134 ; 1,8-pyrenequinone ; 1,8-Dihydropyrene-1,8-dione ; 1,8-Pyrenedione ; 1,8-Pyrrenequinone
Molecular Weight: 232.23352 [g/mol]
Molecular Formula: C16H8O2
XLogP3-AA: 3.2
H-Bond Donor: 0
H-Bond Acceptor: 2
EINECS: 218-966-9
Canonical SMILES: C1=CC2=C3C(=CC=C4C3=C1C=CC4=O)C(=O)C=C2
InChI: InChI=1S/C16H8O2/c17-13-7-3-9-1-2-10-4-8-14(18)12-6-5-11(13)15(9)16(10)12/h1-8H
InChIKey: XETOQIJGUBNXLQ-UHFFFAOYSA-N 
Density: 1.439 g/cm3
Flash Point: 177.8 °C
Enthalpy of Vaporization: 74.35 kJ/mol
Boiling Point: 479.2 °C at 760 mmHg
Vapour Pressure: 2.4E-09 mmHg at 25°C
Following is the molecular structure of 1,8-Pyrenedione(CAS NO.2304-85-0) is:

Toxicity Data With Reference

1.    

mmo-sat 2 µg/plate

     MUREAV    Mutation Research. 156 (1985),61.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.

Specification

1,8-Pyrenedione(CAS NO.2304-85-0) is a RN given refers to cpd with locants for oxo moiety in positions 1 and 8.