ChemSpider 2D Image | 2-Methyl-2-propanyl (2-cyano-2-propanyl)carbamate | C9H16N2O2

2-Methyl-2-propanyl (2-cyano-2-propanyl)carbamate

  • Molecular FormulaC9H16N2O2
  • Average mass184.236 Da
  • Monoisotopic mass184.121185 Da
  • ChemSpider ID13504094

More details:

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

(2-Cyano-2-propanyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (2-cyano-2-propanyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2-cyan-2-propanyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-(1-cyano-1-methylethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
(cyano-dimethyl-methyl)-carbamic acid tert-butyl ester
[133117-97-2] [RN]
133117-97-2 [RN]
CARBAMIC ACID (1-CYANO-ISOPROPYL)-,TERT-BUTYL ESTER
Carbamic acid, (1-cyano-1-methylethyl)-, 1,1-dimethylethyl ester (9CI)
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4530014/
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.0±0.1 g/cm3
    Boiling Point: 286.5±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.6±3.0 kJ/mol
    Flash Point: 127.1±22.6 °C
    Index of Refraction: 1.448
    Molar Refractivity: 49.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.29
    ACD/LogD (pH 5.5): 1.60
    ACD/BCF (pH 5.5): 9.64
    ACD/KOC (pH 5.5): 176.26
    ACD/LogD (pH 7.4): 1.60
    ACD/BCF (pH 7.4): 9.61
    ACD/KOC (pH 7.4): 175.57
    Polar Surface Area: 62 Å2
    Polarizability: 19.4±0.5 10-24cm3
    Surface Tension: 33.9±3.0 dyne/cm
    Molar Volume: 182.9±3.0 cm3

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