ChemSpider 2D Image | jamaicamide A | C27H36BrClN2O4

jamaicamide A

  • Molecular FormulaC27H36BrClN2O4
  • Average mass567.943 Da
  • Monoisotopic mass566.154663 Da
  • ChemSpider ID28295601

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(4E,9E)-14-Brom-9-(chlormethylen)-N-{(3E)-3-methoxy-5-[(2S)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-5-oxo-3-penten-1-yl}-6-methyl-4-tetradecen-13-inamid [German] [ACD/IUPAC Name]
(4E,9E)-14-Bromo-9-(chloromethylene)-N-{(3E)-3-methoxy-5-[(2S)-2-methyl-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-5-oxo-3-penten-1-yl}-6-methyl-4-tetradecen-13-ynamide [ACD/IUPAC Name]
(4E,9E)-14-Bromo-9-(chlorométhylène)-N-{(3E)-3-méthoxy-5-[(2S)-2-méthyl-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-5-oxo-3-pentén-1-yl}-6-méthyl-4-tétradécén-13-ynamide [French] [ACD/IUPAC Name]
4-Tetradecen-13-ynamide, 14-bromo-9-(chloromethylene)-N-[(3E)-5-[(2S)-2,5-dihydro-2-methyl-5-oxo-1H-pyrrol-1-yl]-3-methoxy-5-oxo-3-penten-1-yl]-6-methyl-, (4E,9E)- [ACD/Index Name]
jamaicamide A

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.551
Molar Refractivity: 144.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 6.82
ACD/LogD (pH 5.5): 5.76
ACD/BCF (pH 5.5): 14172.60
ACD/KOC (pH 5.5): 32598.34
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 14172.62
ACD/KOC (pH 7.4): 32598.38
Polar Surface Area: 76 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 451.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement