ChemSpider 2D Image | N-Acetyl-S-(2-carboxypropyl)-D-cysteine | C9H15NO5S

N-Acetyl-S-(2-carboxypropyl)-D-cysteine

  • Molecular FormulaC9H15NO5S
  • Average mass249.284 Da
  • Monoisotopic mass249.067093 Da
  • ChemSpider ID23976866

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

D-Cysteine, N-acetyl-S-(2-carboxypropyl)- [ACD/Index Name]
N-Acetyl-S-(2-carboxypropyl)-D-cystein [German] [ACD/IUPAC Name]
N-Acetyl-S-(2-carboxypropyl)-D-cysteine [ACD/IUPAC Name]
N-Acétyl-S-(2-carboxypropyl)-D-cystéine [French] [ACD/IUPAC Name]
910898-81-6 [RN]
N-Acetyl-S-(2-carboxypropyl)-L-cysteine (Mixture of Diastereomers)
N-Acetyl-S-(2-carboxypropyl)-L-cysteine Dicyclohexylammonium Salt (Mixture of Diastereomers)
N-Acetyl-S-(2-carboxypropyl)-L-cysteineDicyclohexylammoniumSalt(MixtureofDiastereomers)

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

Density: 1.3±0.1 g/cm3
Boiling Point: 562.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 92.4±6.0 kJ/mol
Flash Point: 293.9±30.1 °C
Index of Refraction: 1.537
Molar Refractivity: 58.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.18
ACD/LogD (pH 5.5): -4.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 187.0±3.0 cm3

Click to predict properties on the Chemicalize site


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