ChemSpider 2D Image | Bis(2-methyl-2-propanyl) 4,4'-[(6-methyl-2,4-pyrimidinediyl)bis(oxy)]di(1-piperidinecarboxylate) | C25H40N4O6

Bis(2-methyl-2-propanyl) 4,4'-[(6-methyl-2,4-pyrimidinediyl)bis(oxy)]di(1-piperidinecarboxylate)

  • Molecular FormulaC25H40N4O6
  • Average mass492.608 Da
  • Monoisotopic mass492.294800 Da
  • ChemSpider ID27458530

More details:

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

1289386-35-1 [RN]
1-Piperidinecarboxylic acid, 4,4'-[(6-methyl-2,4-pyrimidinediyl)bis(oxy)]bis-, bis(1,1-dimethylethyl) ester [ACD/Index Name]
1-Piperidinecarboxylic acid, 4-[[2-[[1-[(1,1-dimethylethoxy)carbonyl]-4-piperidinyl]oxy]-6-methyl-4-pyrimidinyl]oxy]-, 1,1-dimethylethyl ester
4,4'-[(6-Méthyl-2,4-pyrimidinediyl)bis(oxy)]di(1-pipéridinecarboxylate) de bis(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl) 4,4'-[(6-methyl-2,4-pyrimidinediyl)bis(oxy)]di(1-piperidinecarboxylate) [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl)-4,4'-[(6-methyl-2,4-pyrimidindiyl)bis(oxy)]di(1-piperidincarboxylat) [German] [ACD/IUPAC Name]
TERT-BUTYL 4-{[2-({1-[(TERT-BUTOXY)CARBONYL]PIPERIDIN-4-YL}OXY)-6-METHYLPYRIMIDIN-4-YL]OXY}PIPERIDINE-1-CARBOXYLATE
Di-tert-butyl 4,4'-((6-methylpyrimidine-2,4-diyl)bis(oxy))bis(piperidine-1-carboxylate)
MFCD18837358
tert-butyl 4-((2-(1-(tert-butoxycarbonyl)piperidin-4-yloxy))-6-methyl-pyrimidin-4-yloxy)piperidine-1-carboxylate
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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: 607.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 321.0±34.3 °C
Index of Refraction: 1.530
Molar Refractivity: 130.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 828.67
ACD/KOC (pH 5.5): 4265.68
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 832.60
ACD/KOC (pH 7.4): 4285.91
Polar Surface Area: 103 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 47.4±3.0 dyne/cm
Molar Volume: 421.7±3.0 cm3

Click to predict properties on the Chemicalize site


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