Found 3 results

Search term: WEKBGFBWJOHXKR (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (~2~H_7_)Propyl 4-(sulfooxy)benzoate | C10H5D7O6S

(2H7)Propyl 4-(sulfooxy)benzoate

  • Molecular FormulaC10H5D7O6S
  • Average mass267.307 Da
  • Monoisotopic mass267.079407 Da
  • ChemSpider ID58794651
  • Non-standard isotope - Non-standard isotope


More details:






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

(2H7)Propyl 4-(sulfooxy)benzoate [ACD/IUPAC Name]
(2H7)Propyl-4-(sulfooxy)benzoat [German] [ACD/IUPAC Name]
4-(Sulfooxy)benzoate de (2H7)propyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(sulfooxy)-, 1-propyl-d7 ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.548
Molar Refractivity: 59.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): -2.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 186.4±3.0 cm3

Click to predict properties on the Chemicalize site






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