ChemSpider 2D Image | [(4-Methyl-1-piperidinyl)sulfonyl]acetic acid | C8H15NO4S

[(4-Methyl-1-piperidinyl)sulfonyl]acetic acid

  • Molecular FormulaC8H15NO4S
  • Average mass221.274 Da
  • Monoisotopic mass221.072174 Da
  • ChemSpider ID21785130

More details:

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

[(4-Methyl-1-piperidinyl)sulfonyl]acetic acid [ACD/IUPAC Name]
[(4-Methyl-1-piperidinyl)sulfonyl]essigsäure [German] [ACD/IUPAC Name]
1042628-18-1 [RN]
2-[(4-methylpiperidin-1-yl)sulfonyl]acetic acid
Acetic acid, 2-[(4-methyl-1-piperidinyl)sulfonyl]- [ACD/Index Name]
Acide [(4-méthyl-1-pipéridinyl)sulfonyl]acétique [French] [ACD/IUPAC Name]
(4-METHYLPIPERIDIN-1-YLSULFONYL)ACETIC ACID
(4-Methyl-piperidine-1-sulfonyl)-acetic acid
2-(4-methylpiperidine-1-sulfonyl)acetic acid
MFCD11107720 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 391.3±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 70.3±6.0 kJ/mol
Flash Point: 190.4±28.4 °C
Index of Refraction: 1.538
Molar Refractivity: 51.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.96
ACD/LogD (pH 5.5): -1.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 164.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement