ChemSpider 2D Image | N-[(3R)-7-Amino-1-chloro-2-oxo-3-heptanyl]-4-methylbenzenesulfonamide | C14H21ClN2O3S

N-[(3R)-7-Amino-1-chloro-2-oxo-3-heptanyl]-4-methylbenzenesulfonamide

  • Molecular FormulaC14H21ClN2O3S
  • Average mass332.846 Da
  • Monoisotopic mass332.096130 Da
  • ChemSpider ID26374489

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzenesulfonamide, N-[(1R)-5-amino-1-(2-chloroacetyl)pentyl]-4-methyl- [ACD/Index Name]
N-[(3R)-7-Amino-1-chlor-2-oxo-3-heptanyl]-4-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
N-[(3R)-7-Amino-1-chloro-2-oxo-3-heptanyl]-4-methylbenzenesulfonamide [ACD/IUPAC Name]
N-[(3R)-7-Amino-1-chloro-2-oxo-3-heptanyl]-4-méthylbenzènesulfonamide [French] [ACD/IUPAC Name]
N-[(3R)-7-amino-1-chloro-2-oxoheptan-3-yl]-4-methylbenzenesulfonamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 509.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 262.1±32.9 °C
Index of Refraction: 1.546
Molar Refractivity: 84.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): -1.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 267.9±3.0 cm3

Click to predict properties on the Chemicalize site


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