Found 6 results

Search term: MF = 'C_{25}H_{38}ClNO_{5}'
ChemSpider 2D Image | malyngamide T | C25H38ClNO5

malyngamide T

  • Molecular FormulaC25H38ClNO5
  • Average mass468.026 Da
  • Monoisotopic mass467.243866 Da
  • ChemSpider ID27022899

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2H-Pyran-2-one, 6-[(2E)-3-chloro-2-[[(5E,8S)-8-methoxy-2-oxo-5-pentadecen-1-yl]amino]-2-propen-1-yl]-4-methoxy- [ACD/Index Name]
6-[(2E)-3-Chlor-2-{[(5E,8S)-8-methoxy-2-oxo-5-pentadecen-1-yl]amino}-2-propen-1-yl]-4-methoxy-2H-pyran-2-on [German] [ACD/IUPAC Name]
6-[(2E)-3-Chloro-2-{[(5E,8S)-8-methoxy-2-oxo-5-pentadecen-1-yl]amino}-2-propen-1-yl]-4-methoxy-2H-pyran-2-one [ACD/IUPAC Name]
6-[(2E)-3-Chloro-2-{[(5E,8S)-8-méthoxy-2-oxo-5-pentadécén-1-yl]amino}-2-propén-1-yl]-4-méthoxy-2H-pyran-2-one [French] [ACD/IUPAC Name]
malyngamide T

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

Density: 1.1±0.1 g/cm3
Boiling Point: 627.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.9±3.0 kJ/mol
Flash Point: 333.4±31.5 °C
Index of Refraction: 1.519
Molar Refractivity: 128.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 5.36
ACD/BCF (pH 5.5): 6930.04
ACD/KOC (pH 5.5): 19533.61
ACD/LogD (pH 7.4): 5.36
ACD/BCF (pH 7.4): 6930.45
ACD/KOC (pH 7.4): 19534.74
Polar Surface Area: 74 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 41.8±5.0 dyne/cm
Molar Volume: 423.9±5.0 cm3

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