Found 144 results

Search term: MF = 'C_{11}H_{12}ClF_{3}N_{2}O_{2}S'
ChemSpider 2D Image | (3R)-1-{[2-Chloro-4-(trifluoromethyl)phenyl]sulfonyl}-3-pyrrolidinamine | C11H12ClF3N2O2S

(3R)-1-{[2-Chloro-4-(trifluoromethyl)phenyl]sulfonyl}-3-pyrrolidinamine

  • Molecular FormulaC11H12ClF3N2O2S
  • Average mass328.738 Da
  • Monoisotopic mass328.026001 Da
  • ChemSpider ID57975116

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-1-{[2-Chlor-4-(trifluormethyl)phenyl]sulfonyl}-3-pyrrolidinamin [German] [ACD/IUPAC Name]
(3R)-1-{[2-Chloro-4-(trifluoromethyl)phenyl]sulfonyl}-3-pyrrolidinamine [ACD/IUPAC Name]
(3R)-1-{[2-Chloro-4-(trifluorométhyl)phényl]sulfonyl}-3-pyrrolidinamine [French] [ACD/IUPAC Name]
3-Pyrrolidinamine, 1-[[2-chloro-4-(trifluoromethyl)phenyl]sulfonyl]-, (3R)- [ACD/Index 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: 393.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.3±3.0 kJ/mol
Flash Point: 191.7±30.7 °C
Index of Refraction: 1.543
Molar Refractivity: 69.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): -0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 2.27
ACD/KOC (pH 7.4): 32.90
Polar Surface Area: 72 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 44.1±3.0 dyne/cm
Molar Volume: 220.1±3.0 cm3

Click to predict properties on the Chemicalize site


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