ChemSpider 2D Image | (2Z)-4-Oxo-4-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-butenoic acid | C14H16N2O5S

(2Z)-4-Oxo-4-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-butenoic acid

  • Molecular FormulaC14H16N2O5S
  • Average mass324.352 Da
  • Monoisotopic mass324.078003 Da
  • ChemSpider ID23014859

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-4-Oxo-4-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-butenoic acid [ACD/IUPAC Name]
(2Z)-4-Oxo-4-{[4-(1-pyrrolidinylsulfonyl)phenyl]amino}-2-butensäure [German] [ACD/IUPAC Name]
(2Z)-4-Oxo-4-{[4-(pyrrolidin-1-ylsulfonyl)phenyl]amino}but-2-enoic acid
2-Butenoic acid, 4-oxo-4-[[4-(1-pyrrolidinylsulfonyl)phenyl]amino]-, (2Z)- [ACD/Index Name]
Acide (2Z)-4-oxo-4-{[4-(1-pyrrolidinylsulfonyl)phényl]amino}-2-buténoïque [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.640
Molar Refractivity: 79.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): -2.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.72
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 70.8±3.0 dyne/cm
Molar Volume: 221.4±3.0 cm3

Click to predict properties on the Chemicalize site


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