ChemSpider 2D Image | 4-[(S)-(4-Hydroxyphenyl)(2-pyridinyl)methyl]phenyl hydrogen sulfate | C18H15NO5S

4-[(S)-(4-Hydroxyphenyl)(2-pyridinyl)methyl]phenyl hydrogen sulfate

  • Molecular FormulaC18H15NO5S
  • Average mass357.380 Da
  • Monoisotopic mass357.067108 Da
  • ChemSpider ID34987430

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-[(S)-(4-Hydroxyphenyl)(2-pyridinyl)methyl]phenyl hydrogen sulfate [ACD/IUPAC Name]
4-[(S)-(4-Hydroxyphenyl)(2-pyridinyl)methyl]phenylhydrogensulfat [German] [ACD/IUPAC Name]
Hydrogénosulfate de 4-[(S)-(4-hydroxyphényl)(2-pyridinyl)méthyl]phényle [French] [ACD/IUPAC Name]
Phenol, 4-[(S)-(4-hydroxyphenyl)-2-pyridinylmethyl]-, 1-(hydrogen sulfate) [ACD/Index Name]
51264-33-6 [RN]
PICOMONOSULFATE
UNII-7SZ0W4Q693

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: 1.658
Molar Refractivity: 92.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): -1.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 105 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 67.3±3.0 dyne/cm
Molar Volume: 250.4±3.0 cm3

Click to predict properties on the Chemicalize site


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