ChemSpider 2D Image | 2-Methyl-2-propanyl 4-[(1R,2S)-2-(hydroxymethyl)cyclopropyl]-1-piperidinecarboxylate | C14H25NO3

2-Methyl-2-propanyl 4-[(1R,2S)-2-(hydroxymethyl)cyclopropyl]-1-piperidinecarboxylate

  • Molecular FormulaC14H25NO3
  • Average mass255.353 Da
  • Monoisotopic mass255.183441 Da
  • ChemSpider ID28184897

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-Piperidinecarboxylic acid, 4-[(1R,2S)-2-(hydroxymethyl)cyclopropyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[(1R,2S)-2-(hydroxymethyl)cyclopropyl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[(1R,2S)-2-(hydroxymethyl)cyclopropyl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[(1R,2S)-2-(Hydroxyméthyl)cyclopropyl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
[1192063-94-7] [RN]
1192063-94-7 [RN]
BR-47765
MFCD19689669
tert-Butyl 4-((1R,2S)-2-(hydroxymethyl)cyclopropyl)piperidine-1-carboxylate
tert-Butyl 4-[(1R,2S)-2-(hydroxymethyl)cyclopropyl]piperidine-1-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 355.8±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 69.6±6.0 kJ/mol
Flash Point: 169.0±20.4 °C
Index of Refraction: 1.516
Molar Refractivity: 69.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.40
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.23
ACD/KOC (pH 5.5): 408.68
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.23
ACD/KOC (pH 7.4): 408.68
Polar Surface Area: 50 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 230.2±3.0 cm3

Click to predict properties on the Chemicalize site


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