Found 4253 results

Search term: MF = 'C_{11}H_{12}FNO_{2}'
ChemSpider 2D Image | (3R,4S)-4-(4-Fluorophenyl)-3-pyrrolidinecarboxylic acid | C11H12FNO2

(3R,4S)-4-(4-Fluorophenyl)-3-pyrrolidinecarboxylic acid

  • Molecular FormulaC11H12FNO2
  • Average mass209.217 Da
  • Monoisotopic mass209.085205 Da
  • ChemSpider ID23500067

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4S)-4-(4-Fluorophenyl)-3-pyrrolidinecarboxylic acid [ACD/IUPAC Name]
(3R,4S)-4-(4-Fluorphenyl)-3-pyrrolidincarbonsäure [German] [ACD/IUPAC Name]
(3R,4S)-rel-4-(4-Fluorophenyl)pyrrolidine-3-carboxylic acid
1330830-35-7 [RN]
3-Pyrrolidinecarboxylic acid, 4-(4-fluorophenyl)-, (3R,4S)- [ACD/Index Name]
Acide (3R,4S)-4-(4-fluorophényl)-3-pyrrolidinecarboxylique [French] [ACD/IUPAC Name]
(3R,4S)-4-(4-fluorophenyl)pyrrolidine-3-carboxylic acid
(3S,4R)-4-(4-FLUOROPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID
1047651-77-3 [RN]
1260587-88-9 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 369.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.0±3.0 kJ/mol
Flash Point: 177.4±27.9 °C
Index of Refraction: 1.546
Molar Refractivity: 52.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.17
ACD/LogD (pH 5.5): -1.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 49 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 165.4±3.0 cm3

Click to predict properties on the Chemicalize site


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