Found 3 results

Search term: FBFBHMFJYSHVAI (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Methyl-2-propanyl (4R)-5-[(2S,3R,4R)-3-hydroxy-4-methyl-5-hexen-2-yl]-2,2,4-trimethyl-1,3-oxazolidine-3-carboxylate | C18H33NO4

2-Methyl-2-propanyl (4R)-5-[(2S,3R,4R)-3-hydroxy-4-methyl-5-hexen-2-yl]-2,2,4-trimethyl-1,3-oxazolidine-3-carboxylate

  • Molecular FormulaC18H33NO4
  • Average mass327.459 Da
  • Monoisotopic mass327.240967 Da
  • ChemSpider ID30651071

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(4R)-5-[(2S,3R,4R)-3-Hydroxy-4-méthyl-5-hexén-2-yl]-2,2,4-triméthyl-1,3-oxazolidine-3-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (4R)-5-[(2S,3R,4R)-3-hydroxy-4-methyl-5-hexen-2-yl]-2,2,4-trimethyl-1,3-oxazolidine-3-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(4R)-5-[(2S,3R,4R)-3-hydroxy-4-methyl-5-hexen-2-yl]-2,2,4-trimethyl-1,3-oxazolidin-3-carboxylat [German] [ACD/IUPAC Name]
3-Oxazolidinecarboxylic acid, 5-[(1S,2R,3R)-2-hydroxy-1,3-dimethyl-4-penten-1-yl]-2,2,4-trimethyl-, 1,1-dimethylethyl ester, (4R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 403.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.6±6.0 kJ/mol
Flash Point: 197.7±25.9 °C
Index of Refraction: 1.470
Molar Refractivity: 91.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.99
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 258.83
ACD/KOC (pH 5.5): 1857.13
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 258.83
ACD/KOC (pH 7.4): 1857.13
Polar Surface Area: 59 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 32.4±3.0 dyne/cm
Molar Volume: 327.9±3.0 cm3

Click to predict properties on the Chemicalize site


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