ChemSpider 2D Image | (3S)-3-(Hydroxyamino)-3-phenylpropanoate | C9H10NO3

(3S)-3-(Hydroxyamino)-3-phenylpropanoate

  • Molecular FormulaC9H10NO3
  • Average mass180.181 Da
  • Monoisotopic mass180.066620 Da
  • ChemSpider ID24604951

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-(Hydroxyamino)-3-phenylpropanoat [German] [ACD/IUPAC Name]
(3S)-3-(Hydroxyamino)-3-phenylpropanoate [ACD/IUPAC Name]
(3S)-3-(Hydroxyamino)-3-phénylpropanoate [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-(hydroxyamino)-, ion(1-), (βS)- [ACD/Index Name]
ZINC00409853

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

Density:
Boiling Point: 381.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 184.8±30.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.13
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.52
ACD/LogD (pH 7.4): -2.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 72 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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