ChemSpider 2D Image | Bromophenol Blue | C19H10Br4O5S

Bromophenol Blue

  • Molecular FormulaC19H10Br4O5S
  • Average mass669.961 Da
  • Monoisotopic mass665.698242 Da
  • ChemSpider ID7973

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Featured data source



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

115-39-9 [RN]
4,4'-(1,1-Dioxido-3H-2,1-benzoxathiol-3,3-diyl)bis(2,6-dibromphenol) [German] [ACD/IUPAC Name]
4,4'-(1,1-Dioxido-3H-2,1-benzoxathiole-3,3-diyl)bis(2,6-dibromophenol) [ACD/IUPAC Name]
4,4'-(1,1-Dioxydo-3H-2,1-benzoxathiole-3,3-diyl)bis(2,6-dibromophénol) [French] [ACD/IUPAC Name]
4,4'-(3H-2,1-Benzoxathiol-3-ylidene)bis[2,6-dibromophenol] S,S-Dioxide
a,a-Bis(3,5-dibromo-4-hydroxyphenyl)-a-hydroxy-o-toluenesulfonicAcid g-Sultone
Bromophenol Blue [Wiki]
Bromphenol Blue
Phenol, 4,4'-(1,1-dioxido-3H-2,1-benzoxathiol-3-ylidene)bis[2,6-dibromo- [ACD/Index Name]
,3″
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

114391_SIAL [DBID]
18046_FLUKA [DBID]
32712_RIEDEL [DBID]
AI3-52697 [DBID]
AIDS030499 [DBID]
AIDS-030499 [DBID]
B0126_SIAL [DBID]
BRN 0061698 [DBID]
CCRIS 5487 [DBID]
NSC 7818 [DBID]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 2.2±0.1 g/cm3
Boiling Point: 605.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 320.1±31.5 °C
Index of Refraction: 1.744
Molar Refractivity: 123.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 6.88
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 435.48
ACD/KOC (pH 5.5): 670.26
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 4.30
ACD/KOC (pH 7.4): 6.63
Polar Surface Area: 92 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 74.2±3.0 dyne/cm
Molar Volume: 304.5±3.0 cm3

Click to predict properties on the Chemicalize site





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