ChemSpider 2D Image | TERT-BUTYL 4-[(2-CHLOROPYRIMIDIN-4-YL)(METHYL)AMINO]PIPERIDINE-1-CARBOXYLATE | C15H23ClN4O2

TERT-BUTYL 4-[(2-CHLOROPYRIMIDIN-4-YL)(METHYL)AMINO]PIPERIDINE-1-CARBOXYLATE

  • Molecular FormulaC15H23ClN4O2
  • Average mass326.822 Da
  • Monoisotopic mass326.150940 Da
  • ChemSpider ID27458158

More details:

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

1261233-58-2 [RN]
1-Piperidinecarboxylic acid, 4-[(2-chloro-4-pyrimidinyl)methylamino]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[(2-chloro-4-pyrimidinyl)(methyl)amino]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[(2-chlor-4-pyrimidinyl)(methyl)amino]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[(2-Chloro-4-pyrimidinyl)(méthyl)amino]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
TERT-BUTYL 4-[(2-CHLOROPYRIMIDIN-4-YL)(METHYL)AMINO]PIPERIDINE-1-CARBOXYLATE
4-[(2-Chloropyrimidin-4-yl)methylamino]piperidine-1-carboxylic acid tert-butyl ester
4-[(2-Chloro-pyrimidin-4-yl)-methyl-amino]piperidine-1-carboxylic acid tert-butyl ester
4-[(2-Chloro-pyrimidin-4-yl)-methyl-amino]-piperidine-1-carboxylic acid tert-butyl ester
MFCD18380428
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 465.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 235.4±25.9 °C
Index of Refraction: 1.562
Molar Refractivity: 86.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 75.25
ACD/KOC (pH 5.5): 765.49
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 75.78
ACD/KOC (pH 7.4): 770.86
Polar Surface Area: 59 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 266.6±3.0 cm3

Click to predict properties on the Chemicalize site


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