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Cas Database |
| Name |
5-Bromo-1,3-benzenedicarbonitrile |
EINECS | N/A |
| CAS No. | 160892-07-9 | Density | 1.68 |
| PSA | 47.58000 | LogP | 2.19246 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C8H3 Br N2 | Boiling Point | 257 ºC |
| Molecular Weight | 207.029 | Flash Point | 109 ºC |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
5-Bromo-1,3-benzenedicarbonitrile;5-Bromoisophthalonitrile |
Article Data | 2 |
5-Bromo-1,3-benzenedicarbonitrile Chemical Properties
Molecule structure of 5-Bromo-1,3-benzenedicarbonitrile (CAS NO.160892-07-9):
Systematic Name: 5-Bromobenzene-1,3-dicarbonitrile
Molecular Formula: C8H3BrN2
Molecular Weight: 207.03 g/mol
CAS Registry Number: 160892-07-9
Index of Refraction: 1.626
Molar Refractivity: 43.609 cm3
Molar Volume: 123.178 cm3
Polarizability: 17.288×10-24 cm3
Surface Tension: 66.484 dyne/cm
Density: 1.681 g/cm3
Flash Point: 109.121 °C
Enthalpy of Vaporization: 49.435 kJ/mol
Boiling Point: 256.82 °C at 760 mmHg
Vapour Pressure: 0.015 mmHg at 25 °C
SMILES: N#Cc1cc(cc(Br)c1)C#N
InChI: InChI=1/C8H3BrN2/c9-8-2-6(4-10)1-7(3-8)5-11/h1-3H
InChIKey: KEODZYDOBHDZOT-UHFFFAOYAL
Std. InChI: InChI=1S/C8H3BrN2/c9-8-2-6(4-10)1-7(3-8)5-11/h1-3H
Std. InChIKey of 5-Bromo-1,3-benzenedicarbonitrile (CAS NO.160892-07-9): KEODZYDOBHDZOT-UHFFFAOYSA-N
5-Bromo-1,3-benzenedicarbonitrile Specification
5-Bromo-1,3-benzenedicarbonitrile (CAS NO.160892-07-9) is also named as 1,3-Benzenedicarbonitrile,5-bromo- ; 5-Bromoisophthalonitrile ; 5-Bromobenzene-1,3-dicarbonitrile .
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