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105836-99-5

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Basic Information
CAS No.: 105836-99-5
Name: 1,7-Dinitrophenazine
Molecular Structure:
Molecular Structure of 105836-99-5 (1,7-Dinitrophenazine)
Formula: C12H6 N4 O4
Molecular Weight: 270.204
Synonyms: 1,7-DINITROPHENAZINE
Density: 1.61g/cm3
Boiling Point: 522.4°Cat760mmHg
Flash Point: 269.7°C
Safety: Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
PSA: 117.42000
LogP: 3.64580
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Chemistry

Product Name: 1,7-Dinitrophenazine 
CAS Registry Number: 105836-99-5 
Synonyms: 1,7-Dinitrophenazine ; CCRIS 3017 
Systematic Name: 1,7-Dinitrophenazine ; Phenazine, 1,7-dinitro- 
IUPAC Name: 1,7-dinitrophenazine
Molecular Weight: 270.20044 [g/mol]
Molecular Formula: C12H6N4O4
XLogP3-AA: 2.3
H-Bond Acceptor: 6 
Surface Tension: 88.1 dyne/cm
Density: 1.61 g/cm3
Flash Point: 269.7 °C
Enthalpy of Vaporization: 76.58 kJ/mol
Boiling Point: 522.4 °C at 760 mmHg
Vapour Pressure: 1.73E-10 mmHg at 25°C
Following is the molecular structure of 1,7-Dinitrophenazine (CAS NO.105836-99-5) is:

Toxicity Data With Reference

1.    

mic-sat 100 ng/plate

     MUREAV    Mutation Research. 225 (1989),75.

Safety Profile

Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.

Specification

Descriptors computed from structure, you can know some information about 1,7-Dinitrophenazine (CAS NO.105836-99-5) :
Canonical SMILES: C1=CC2=C(C(=C1)[N+](=O)[O-])N=C3C=CC(=CC3=N2)[N+](=O)[O-]
InChI: InChI=1S/C12H6N4O4/c17-15(18)7-4-5-8-10(6-7)13-9-2-1-3-11(16(19)20)12(9)14-8/h1-6H
InChIKey: XVHUXSNDANREND-UHFFFAOYSA-N
Exact Mass: 270.038905
MonoIsotopic Mass: 270.038905
Topological Polar Surface Area: 112
Heavy Atom Count: 20