ChemSpider 2D Image | S-2-Propyn-1-yl-D-cysteine | C6H9NO2S

S-2-Propyn-1-yl-D-cysteine

  • Molecular FormulaC6H9NO2S
  • Average mass159.206 Da
  • Monoisotopic mass159.035400 Da
  • ChemSpider ID28536335

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Cysteine, S-2-propyn-1-yl- [ACD/Index Name]
S-2-Propin-1-yl-D-cystein [German] [ACD/IUPAC Name]
S-2-Propyn-1-yl-D-cysteine [ACD/IUPAC Name]
S-2-Propyn-1-yl-D-cystéine [French] [ACD/IUPAC Name]
(2S)-2-AMINO-3-(PROP-2-YN-1-YLSULFANYL)PROPANOIC ACID
(S)-2-Amino-3-(prop-2-yn-1-ylthio)propanoic acid
(S)-2-Amino-3-(prop-2-yn-1-ylthio)propanoicacid
[906365-65-9] [RN]
906365-65-9 [RN]
MFCD17215395 [MDL number]
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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: 294.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 58.8±6.0 kJ/mol
Flash Point: 132.1±27.3 °C
Index of Refraction: 1.571
Molar Refractivity: 40.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): -1.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 62.6±3.0 dyne/cm
Molar Volume: 124.0±3.0 cm3

Click to predict properties on the Chemicalize site


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