ChemSpider 2D Image | 2,4,6-Tribromoaniline | C6H4Br3N

2,4,6-Tribromoaniline

  • Molecular FormulaC6H4Br3N
  • Average mass329.815 Da
  • Monoisotopic mass326.789368 Da
  • ChemSpider ID21106171

More details:



Featured data source



Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2,4,6-Tribromophenyl)amine
147-82-0 [RN]
2,4,6-Tribromanilin [German] [ACD/IUPAC Name]
2,4,6-Tribromoaniline [ACD/IUPAC Name]
2,4,6-Tribromoaniline [French] [ACD/IUPAC Name]
2,4,6-Tribromobenzenamine
205-700-1 [EINECS]
Benzenamine, 2,4,6-tribromo- [ACD/Index Name]
ZR BE DE FE [WLN]
[147-82-0]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

0C2N8WIL3B [DBID]
163694_ALDRICH [DBID]
AI3-21064 [DBID]
AIDS019006 [DBID]
AIDS-019006 [DBID]
BRN 2209258 [DBID]
HSDB 2689 [DBID]
NSC 2216 [DBID]
NSC2216 [DBID]
UNII:0C2N8WIL3B [DBID]
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  • Experimental Physico-chemical Properties
  • Predicted Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      white to light tan powder Oxford University Chemical Safety Data (No longer updated) More details
    • Stability:

      Stable. Incompatible with acids, strong oxidizing agents, acid anhydrides, acid chlorides,chloroformates. Oxford University Chemical Safety Data (No longer updated) More details
    • Toxicity:

      IPR-MUS LD50 500 mg kg-1 Oxford University Chemical Safety Data (No longer updated) More details
    • Safety:

      20/21/22-36/37/38 Alfa Aesar A12453
      26-36/37 Alfa Aesar A12453
      Danger Biosynth W-108111
      GHS05; GHS06; GHS08 Biosynth W-108111
      H301; H311; H315; H318; H331; H373 Biosynth W-108111
      H302-H312-H332-H315-H319-H335 Alfa Aesar A12453
      IRRITANT Matrix Scientific 097469
      P261; P280; P301+P310; P305+P351+P338; P311 Biosynth W-108111
      P261-P280-P305+P351+P338-P304+P340-P405-P501a Alfa Aesar A12453
      Safety glasses, gloves, adequate ventilation. Oxford University Chemical Safety Data (No longer updated) More details
      Toxic/Irritant/Corrosive/Light Sensitive/Keep Cold SynQuest 3630-9-X5, 62373
      Warning Alfa Aesar A12453
      WARNING: Irritates lungs, eyes, skin Alfa Aesar A12453
      WARNING:Harmful by skin absorption/ingestion, irritates skin Alfa Aesar A12453
  • Gas Chromatography
    • Retention Index (Kovats):

      1951 (estimated with error: 89) NIST Spectra mainlib_233454, replib_32486, replib_217192
    • Retention Index (Normal Alkane):

      1635 (Program type: Ramp; Column cl... (show more) ass: Standard non-polar; Column diameter: 0.32 mm; Column length: 25 m; Column type: Capillary; Heat rate: 3 K/min; Start T: 80 C; End T: 260 C; CAS no: 147820; Active phase: Ultra-1; Carrier gas: He; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Okumura, T., retention indices of environmental chemicals on methyl silicone capillary column, Journal of Environmental Chemistry (Japan), 1(2), 1991, 333-358.) NIST Spectra nist ri

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.4±0.1 g/cm3
Boiling Point: 300.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.0±3.0 kJ/mol
Flash Point: 132.9±25.9 °C
Index of Refraction: 1.689
Molar Refractivity: 53.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 452.40
ACD/KOC (pH 5.5): 2769.68
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 452.40
ACD/KOC (pH 7.4): 2769.68
Polar Surface Area: 26 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 140.3±3.0 cm3

Click to predict properties on the Chemicalize site





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