ChemSpider 2D Image | 3-(Carboxymethyl)-4-isopropyl-L-proline | C10H17NO4

3-(Carboxymethyl)-4-isopropyl-L-proline

  • Molecular FormulaC10H17NO4
  • Average mass215.246 Da
  • Monoisotopic mass215.115753 Da
  • ChemSpider ID23224347

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

3-(Carboxymethyl)-4-isopropyl-L-prolin [German] [ACD/IUPAC Name]
3-(Carboxymethyl)-4-isopropyl-L-proline [ACD/IUPAC Name]
3-(Carboxyméthyl)-4-isopropyl-L-proline [French] [ACD/IUPAC Name]
3-(carboxymethyl)-4-propan-2-yl-L-proline
L-Proline, 3-(carboxymethyl)-4-(1-methylethyl)- [ACD/Index Name]
(2S)-3-(CARBOXYMETHYL)-4-(PROPAN-2-YL)PYRROLIDINE-2-CARBOXYLIC ACID
(2S)-3-(CARBOXYMETHYL)-4-ISOPROPYLPYRROLIDINE-2-CARBOXYLIC ACID
(2S,3S,4R)-2-CARBOXY-4-ISOPROPYL-3-PYRROLIDINEACETIC ACID
3-Carboxymethyl-4-isopropyl-pyrrolidine-2-carboxylic acid
52497-36-6 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 416.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 73.5±6.0 kJ/mol
Flash Point: 205.8±24.6 °C
Index of Refraction: 1.493
Molar Refractivity: 52.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.49
ACD/LogD (pH 5.5): -2.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 20.9±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 181.3±3.0 cm3

Click to predict properties on the Chemicalize site


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