Found 3 results

Search term: SQOMPUDOUGDJPH (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-Methyl-2-propanyl 4-[(1S)-1-hydroxyethyl]-1-piperidinecarboxylate | C12H23NO3

2-Methyl-2-propanyl 4-[(1S)-1-hydroxyethyl]-1-piperidinecarboxylate

  • Molecular FormulaC12H23NO3
  • Average mass229.316 Da
  • Monoisotopic mass229.167801 Da
  • ChemSpider ID32793315

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Piperidinecarboxylic acid, 4-[(1S)-1-hydroxyethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
1-Piperidinecarboxylic acid, 4-[(1S)-1-hydroxyethyl]-, 1,1-dimethylethylester
2-Methyl-2-propanyl 4-[(1S)-1-hydroxyethyl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[(1S)-1-hydroxyethyl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
389889-82-1 [RN]
4-[(1S)-1-Hydroxyéthyl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(S)-tert-butyl 4-(1-hydroxyethyl)piperidine-1-carboxylate
CS-15433
MFCD22666103
tert-butyl (S)-4-(1-hydroxyethyl)piperidine-1-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 318.2±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.9±6.0 kJ/mol
Flash Point: 146.2±20.4 °C
Index of Refraction: 1.483
Molar Refractivity: 62.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.23
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 15.32
ACD/KOC (pH 5.5): 245.48
ACD/LogD (pH 7.4): 1.86
ACD/BCF (pH 7.4): 15.32
ACD/KOC (pH 7.4): 245.48
Polar Surface Area: 50 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 217.8±3.0 cm3

Click to predict properties on the Chemicalize site


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