ChemSpider 2D Image | S-PALMITOYL CYSTEINE | C19H37NO3S

S-PALMITOYL CYSTEINE

  • Molecular FormulaC19H37NO3S
  • Average mass359.567 Da
  • Monoisotopic mass359.249420 Da
  • ChemSpider ID25057997

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

114507-35-6 [RN]
L-Cysteine, S-(1-oxohexadecyl)- [ACD/Index Name]
S-PALMITOYL CYSTEINE
S-Palmitoyl-L-cystein [German] [ACD/IUPAC Name]
S-Palmitoyl-L-cysteine [ACD/IUPAC Name]
S-Palmitoyl-L-cystéine [French] [ACD/IUPAC Name]
(2R)-2-amino-3-(hexadecanoylsulfanyl)propanoic acid
(2R)-2-amino-3-hexadecanoylsulfanylpropanoic acid
S-hexadecanoyl-L-cysteine

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

08WQ73S7SV [DBID]
UNII:08WQ73S7SV [DBID]
UNII-08WQ73S7SV [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 480.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.6±6.0 kJ/mol
Flash Point: 244.2±27.3 °C
Index of Refraction: 1.498
Molar Refractivity: 103.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 247.62
ACD/KOC (pH 5.5): 352.60
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 171.69
ACD/KOC (pH 7.4): 244.48
Polar Surface Area: 106 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 351.9±3.0 cm3

Click to predict properties on the Chemicalize site


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