ChemSpider 2D Image | (2R)-Amino[(1R,2S)-2-sulfocyclopropyl]acetic acid | C5H9NO5S

(2R)-Amino[(1R,2S)-2-sulfocyclopropyl]acetic acid

  • Molecular FormulaC5H9NO5S
  • Average mass195.194 Da
  • Monoisotopic mass195.020142 Da
  • ChemSpider ID23288934

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R)-Amino[(1R,2S)-2-sulfocyclopropyl]acetic acid [ACD/IUPAC Name]
(2R)-Amino[(1R,2S)-2-sulfocyclopropyl]essigsäure [German] [ACD/IUPAC Name]
(2R)-amino[(1R,2S)-2-sulfocyclopropyl]ethanoic acid
Acide (2R)-amino[(1R,2S)-2-sulfocyclopropyl]acétique [French] [ACD/IUPAC Name]
Cyclopropaneacetic acid, α-amino-2-sulfo-, (αR,1R,2S)- [ACD/Index Name]
(2R,1'R,2'S)-2-(2'-sulfonocyclopropyl)glycine
953415-62-8 [RN]
CHEMBL389556
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL389556/

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 38.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.93
ACD/LogD (pH 5.5): -6.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 126 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 91.8±5.0 dyne/cm
Molar Volume: 110.9±5.0 cm3

Click to predict properties on the Chemicalize site


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