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CAS No.: | 107555-93-1 |
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Name: | 1,2,3,7,8-Pentabromodibenzofuran |
Molecular Structure: | |
Formula: | C12H3 Br5 O |
Molecular Weight: | 562.70 |
Synonyms: | 1,2,3,7,8-Pentabromodibenzofuran |
Density: | 2.541g/cm3 |
Boiling Point: | 537.5°Cat760mmHg |
Flash Point: | 278.9°C |
Safety: | Experimental reproductive effects reported. When heated to decomposition it emits toxic fumes of NOx and Cl−. |
PSA: | 13.14000 |
LogP: | 7.39850 |
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Chemistry informtion about 1,2,3,7,8-Pentabromodibenzofuran(107555-93-1) is:
IUPAC Name: 1,2,3,7,8-pentabromodibenzofuran
Synonyms: 1,2,3,7,8-Pentabromodibenzofuran ; 1,2,3,7,8-Pebdf
Molecular Weight: 562.67162 [g/mol]
Molecular Formula: C12H3Br5O
XLogP3-AA: 7.1
H-Bond Donor: 0
H-Bond Acceptor: 1
Density: 2.541 g/cm3
Flash Point: 278.9 °C
Enthalpy of Vaporization: 78.39 kJ/mol
Boiling Point: 537.5 °C at 760 mmHg
Vapour Pressure: 4.4E-11 mmHg at 25°C
Following is the molecular structure of 1,2,3,7,8-Pentabromodibenzofuran(107555-93-1) is:
Experimental reproductive effects reported. When heated to decomposition it emits toxic fumes of NOx and Cl−.
Descriptors Computed from Structure about 1,2,3,7,8-Pentabromodibenzofuran(107555-93-1) are:
Canonical SMILES: C1=C2C(=CC(=C1Br)Br)OC3=CC(=C(C(=C23)Br)Br)Br
InChI: InChI=1S/C12H3Br5O/c13-5-1-4-8(2-6(5)14)18-9-3-7(15)11(16)12(17)10(4)9/
h1-3H
InChIKey: QMKPILUKNSMQTD-UHFFFAOYSA-N