ChemSpider 2D Image | (2S)-Amino(4-chloro-2-hydroxy-3-pyrazolidinyl)acetic acid | C5H10ClN3O3

(2S)-Amino(4-chloro-2-hydroxy-3-pyrazolidinyl)acetic acid

  • Molecular FormulaC5H10ClN3O3
  • Average mass195.604 Da
  • Monoisotopic mass195.041061 Da
  • ChemSpider ID109491969

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

(2S)-Amino(4-chlor-2-hydroxy-3-pyrazolidinyl)essigsäure [German] [ACD/IUPAC Name]
(2S)-Amino(4-chloro-2-hydroxy-3-pyrazolidinyl)acetic acid [ACD/IUPAC Name]
3-Pyrazolidineacetic acid, α-amino-4-chloro-2-hydroxy-, (αS)- [ACD/Index Name]
Acide (2S)-amino(4-chloro-2-hydroxy-3-pyrazolidinyl)acétique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 446.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 81.3±6.0 kJ/mol
Flash Point: 223.8±31.5 °C
Index of Refraction: 1.643
Molar Refractivity: 42.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.46
ACD/LogD (pH 5.5): -3.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 99 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 86.9±5.0 dyne/cm
Molar Volume: 116.9±5.0 cm3

Click to predict properties on the Chemicalize site


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