ChemSpider 2D Image | 2-Methyl-2-propanyl {trans-4-[(4-chloro-2-pyrimidinyl)amino]cyclohexyl}carbamate | C15H23ClN4O2

2-Methyl-2-propanyl {trans-4-[(4-chloro-2-pyrimidinyl)amino]cyclohexyl}carbamate

  • Molecular FormulaC15H23ClN4O2
  • Average mass326.822 Da
  • Monoisotopic mass326.150940 Da
  • ChemSpider ID81162636

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

{trans-4-[(4-Chloro-2-pyrimidinyl)amino]cyclohexyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl {trans-4-[(4-chloro-2-pyrimidinyl)amino]cyclohexyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-{trans-4-[(4-chlor-2-pyrimidinyl)amino]cyclohexyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[trans-4-[(4-chloro-2-pyrimidinyl)amino]cyclohexyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2378507-18-5 [RN]
MFCD32203299
tert-butyl N-[(1r,4r)-4-[(4-chloropyrimidin-2-yl)amino]cyclohexyl]carbamate
tert-butylN-[(1r,4r)-4-[(4-chloropyrimidin-2-yl)amino]cyclohexyl]carbamate,trans

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.547
Molar Refractivity: 85.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 176.13
ACD/KOC (pH 5.5): 1405.81
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 177.90
ACD/KOC (pH 7.4): 1419.96
Polar Surface Area: 76 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 51.0±5.0 dyne/cm
Molar Volume: 268.4±5.0 cm3

Click to predict properties on the Chemicalize site


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