ChemSpider 2D Image | [2-({[(4-Methylphenyl)sulfonyl]oxy}methyl)-1-piperidinyl]acetic acid | C15H21NO5S

[2-({[(4-Methylphenyl)sulfonyl]oxy}methyl)-1-piperidinyl]acetic acid

  • Molecular FormulaC15H21NO5S
  • Average mass327.396 Da
  • Monoisotopic mass327.114044 Da
  • ChemSpider ID28296845

More details:

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

[2-({[(4-Methylphenyl)sulfonyl]oxy}methyl)-1-piperidinyl]acetic acid [ACD/IUPAC Name]
[2-({[(4-Methylphenyl)sulfonyl]oxy}methyl)-1-piperidinyl]essigsäure [German] [ACD/IUPAC Name]
1353987-62-8 [RN]
1-Piperidineacetic acid, 2-[[[(4-methylphenyl)sulfonyl]oxy]methyl]- [ACD/Index Name]
2-(2-{[(4-METHYLBENZENESULFONYL)OXY]METHYL}PIPERIDIN-1-YL)ACETIC ACID
Acide [2-({[(4-méthylphényl)sulfonyl]oxy}méthyl)-1-pipéridinyl]acétique [French] [ACD/IUPAC Name]
(2-{[(4-METHYLBENZENESULFONYL)OXY]METHYL}PIPERIDIN-1-YL)ACETIC ACID
[2-(Toluene-4-sulfonyloxymethyl)piperidin-1-yl]acetic acid
[2-(Toluene-4-sulfonyloxymethyl)-piperidin-1-yl]-acetic acid
2-(2-((Tosyloxy)methyl)piperidin-1-yl)acetic acid
More...

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

Density: 1.3±0.1 g/cm3
Boiling Point: 506.8±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 260.3±24.6 °C
Index of Refraction: 1.548
Molar Refractivity: 82.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): -0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 259.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement