ChemSpider 2D Image | (3S,4S)-3-Amino-4-methyl-2-azetidinone | C4H8N2O

(3S,4S)-3-Amino-4-methyl-2-azetidinone

  • Molecular FormulaC4H8N2O
  • Average mass100.119 Da
  • Monoisotopic mass100.063660 Da
  • ChemSpider ID24216778

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4S)-3-Amino-4-methyl-2-azetidinon [German] [ACD/IUPAC Name]
(3S,4S)-3-Amino-4-methyl-2-azetidinone [ACD/IUPAC Name]
(3S,4S)-3-Amino-4-méthyl-2-azétidinone [French] [ACD/IUPAC Name]
(3S,4S)-3-Amino-4-methylazetidin-2-one
2-Azetidinone, 3-amino-4-methyl-, (3S,4S)- [ACD/Index Name]
87791-62-6 [RN]
(3S,4S)-3-amino-4-methyl-azetidin-2-one
(3S,4S)-3-Amino-4-methylazetidin-2-one HCl
[87791-62-6] [RN]
149496-37-7 [RN]
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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: 1.1±0.1 g/cm3
Boiling Point: 282.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.2±3.0 kJ/mol
Flash Point: 124.8±25.4 °C
Index of Refraction: 1.474
Molar Refractivity: 25.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -2.36
ACD/LogD (pH 5.5): -1.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.73
ACD/LogD (pH 7.4): -1.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.84
Polar Surface Area: 55 Å2
Polarizability: 10.1±0.5 10-24cm3
Surface Tension: 33.8±3.0 dyne/cm
Molar Volume: 91.1±3.0 cm3

Click to predict properties on the Chemicalize site


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