ChemSpider 2D Image | tert-butyl 3-hydroxy-3-methylazetidine-1-carboxylate | C9H17NO3

tert-butyl 3-hydroxy-3-methylazetidine-1-carboxylate

  • Molecular FormulaC9H17NO3
  • Average mass187.236 Da
  • Monoisotopic mass187.120850 Da
  • ChemSpider ID27470993

More details:






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

1104083-23-9 [RN]
tert-butyl 3-hydroxy-3-methylazetidine-1-carboxylate
[1104083-23-9] [RN]
1-AZETIDINECARBOXYLIC ACID, 3-HYDROXY-3-METHYL-,1,1-DIMETHYLETHYL ESTER
1-azetidinecarboxylic acid, 3-hydroxy-3-methyl-,1,1-dimethylethyl ester(wx644018)
1-AZETIDINECARBOXYLIC ACID,3-HYDROXY-3-METHYL-,1,1-DIMETHYLETHYL ESTER
1-Boc-3-hydroxy-3-methylazetidine
3-(3-octylureido)propanoic acid
3-Hydroxy-3-methyl-azetidine-1-carboxylic acid tert-butyl ester
AGN-PC-0ABVWX
More...

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

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-42760]
    • Safety:

      20/21/22 Novochemy [NC-42760]
      20/21/36/37/39 Novochemy [NC-42760]
      GHS07; GHS09 Novochemy [NC-42760]
      H332; H403 Novochemy [NC-42760]
      P102; P210; P262; P270; P302+P352; P308+P313 Novochemy [NC-42760]
      Warning Novochemy [NC-42760]
      Xn Novochemy [NC-42760]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 257.4±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 57.5±6.0 kJ/mol
Flash Point: 109.5±25.4 °C
Index of Refraction: 1.500
Molar Refractivity: 48.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.38
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 1.65
ACD/KOC (pH 5.5): 49.77
ACD/LogD (pH 7.4): 0.59
ACD/BCF (pH 7.4): 1.65
ACD/KOC (pH 7.4): 49.77
Polar Surface Area: 50 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 164.6±3.0 cm3

Click to predict properties on the Chemicalize site






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