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Chlorendic Anhydride

Catalog Number
ACMA00017325
Product Name
Chlorendic Anhydride
Category
Polymers
Description
DryPowder;WHITE CRYSTALS.
IUPAC Name
1,7,8,9,10,10-hexachloro-4-oxatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Molecular Weight
370.8g/mol
Molecular Formula
C9H2Cl6O3;C9H2Cl6O3
Canonical SMILES
C12C(C(=O)OC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl
InChI
InChI=1S/C9H2Cl6O3/c10-3-4(11)8(13)2-1(5(16)18-6(2)17)7(3,12)9(8,14)15/h1-2H
InChI Key
FLBJFXNAEMSXGL-UHFFFAOYSA-N
Melting Point
233.0 °C;239 °C;231-235 °C
Density
1.73 kg/L;1.73 g/cm³
Solubility
Readily sol in acetone, benzene, toluene; slightly sol in water, n-hexane, carbon tetrachloride;In water, 0.086 mg/L @ 25 °C /Estimated/;Solubility in water: reaction
Color/Form
Fine white crystals
Complexity
498
Covalently-Bonded Unit Count
1
EC Number
204-077-3
Exact Mass
369.81056g/mol
Formal Charge
0
Heavy Atom Count
18
ICSC Number
1373
Log P
log Kow = 4.4 /Estimated/
Monoisotopic Mass
367.81351g/mol
NSC Number
22229
Other Experimental
Free-flowing;Henry's Law constant=8.8X10-8 atm-cu m/mole @ 25 °C / Estimated/;Hydroxyl radical rate constant=5.5X10-12 cu cm/molecule-sec @ 25 °C /Estimated/
Rotatable Bond Count
0
RTECS Number
RB9080000
Stability
In aqueous solution, chlorendic anhydride is rapidly hydrolysed to chlorendic acid, with a half-life of approximately one hour.
Vapor Pressure
5.5X10-7 mm Hg @ 25 °C /Estimated/
XLogP3
2.4
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