ChemSpider 2D Image | tert-Butyl (5-nitrobenzo[d]isoxazol-3-yl)carbamate | C12H13N3O5

tert-Butyl (5-nitrobenzo[d]isoxazol-3-yl)carbamate

  • Molecular FormulaC12H13N3O5
  • Average mass279.249 Da
  • Monoisotopic mass279.085510 Da
  • ChemSpider ID28473905

More details:

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

(5-Nitro-1,2-benzoxazol-3-yl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (5-nitro-1,2-benzoxazol-3-yl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(5-nitro-1,2-benzoxazol-3-yl)carbamat [German] [ACD/IUPAC Name]
380629-72-1 [RN]
Carbamic acid, N-(5-nitro-1,2-benzisoxazol-3-yl)-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl (5-nitrobenzo[d]isoxazol-3-yl)carbamate
(5-Nitro-1,2-benzisoxazol-3-yl)carbamic acid 1,1-dimethyl ethyl ester
(5-Nitro-1,2-benzisoxazol-3-yl)carbamic acid tert-butyl ester
2-Methyl-5-(methylamino)pyrazine
MFCD11111835
More...

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: 1.4±0.1 g/cm3
    Boiling Point: 395.8±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.6±3.0 kJ/mol
    Flash Point: 193.2±22.3 °C
    Index of Refraction: 1.626
    Molar Refractivity: 70.9±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.24
    ACD/LogD (pH 5.5): 2.74
    ACD/BCF (pH 5.5): 71.09
    ACD/KOC (pH 5.5): 736.40
    ACD/LogD (pH 7.4): 2.74
    ACD/BCF (pH 7.4): 70.80
    ACD/KOC (pH 7.4): 733.47
    Polar Surface Area: 110 Å2
    Polarizability: 28.1±0.5 10-24cm3
    Surface Tension: 57.8±3.0 dyne/cm
    Molar Volume: 200.4±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement