ChemSpider 2D Image | Chloromethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-alaninate | C9H16ClNO4

Chloromethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-alaninate

  • Molecular FormulaC9H16ClNO4
  • Average mass237.681 Da
  • Monoisotopic mass237.076782 Da
  • ChemSpider ID58814003

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Chlormethyl-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-alaninat [German] [ACD/IUPAC Name]
Chloromethyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-D-alaninate [ACD/IUPAC Name]
D-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-, chloromethyl ester [ACD/Index Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-D-alaninate de chlorométhyle [French] [ACD/IUPAC Name]
1932604-50-6 [RN]
chloromethyl (2R)-2-{[(tert-butoxy)carbonyl]amino}propanoate
MFCD30311628
R-2-tert-Butoxycarbonylaminopropionic acid chloromethyl ester
R-2-tert-Butoxycarbonylamino-propionic acid chloromethyl ester

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

Density: 1.2±0.1 g/cm3
Boiling Point: 311.9±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.3±3.0 kJ/mol
Flash Point: 142.4±22.3 °C
Index of Refraction: 1.456
Molar Refractivity: 55.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.79
ACD/KOC (pH 5.5): 239.35
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.78
ACD/KOC (pH 7.4): 239.29
Polar Surface Area: 65 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 35.2±3.0 dyne/cm
Molar Volume: 204.7±3.0 cm3

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