ChemSpider 2D Image | Tris(2,3-dibromopropyl) phosphate | C9H15Br6O4P

Tris(2,3-dibromopropyl) phosphate

  • Molecular FormulaC9H15Br6O4P
  • Average mass697.611 Da
  • Monoisotopic mass691.580750 Da
  • ChemSpider ID29089

More details:

Featured data source

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

126-72-7 [RN]
2,3-dibromo-1-propanol phosphate (3:1)
FireMaster T 23P
Flam mex T 23P
Fyrol HB 32
Phosphate de tris(2,3-dibromopropyle) [French] [ACD/IUPAC Name]
Phosphoric acid tris(2,3-dibromo propyl) ester
Tris(2,3-dibromopropyl) phosphate [ACD/IUPAC Name] [Wiki]
Tris(2,3-dibrompropyl)phosphat [German] [ACD/IUPAC Name]
(2,3-Dibromopropyl) phosphate

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

AI3-19170 [DBID]
BRN 1915153 [DBID]
ES 685 [DBID]
HSDB 2581 [DBID]
NCI-C03270 [DBID]
NSC 3240 [DBID]
NSC3240 [DBID]
RCRA waste no. U235 [DBID]
RCRA waste number U235 [DBID]
  • Experimental Physico-chemical Properties
  • Gas Chromatography
    • Retention Index (Normal Alkane):

      2918.9 (Program type: Ramp; Column cl... (show more) ass: Standard non-polar; Column length: 1.1 m; Column type: Packed; Heat rate: 8.5 K/min; Start T: 50 C; End T: 300 C; CAS no: 126727; Active phase: OV-101; Carrier gas: N2; Substrate: Chromosorb W HP; Data type: Normal alkane RI; Authors: Saxton, W.L., Emergence temperature indices and relative retention times of pesticides and industrial chemicals determined by linear programmed temperature gas chromatography, J. Chromatogr., 393, 1987, 175-194.) NIST Spectra nist ri

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

Density: 2.3±0.1 g/cm3
Boiling Point: 544.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 282.9±30.1 °C
Index of Refraction: 1.595
Molar Refractivity: 102.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 3.71
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 1588.54
ACD/KOC (pH 5.5): 6805.68
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1588.54
ACD/KOC (pH 7.4): 6805.68
Polar Surface Area: 55 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 300.5±3.0 cm3

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