Found 4 results

Search term: NUFXPJOTSOMKFZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | indolmycenic acid | C12H13NO3

indolmycenic acid

  • Molecular FormulaC12H13NO3
  • Average mass219.236 Da
  • Monoisotopic mass219.089539 Da
  • ChemSpider ID57618323

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3R)-2-Hydroxy-3-(1H-indol-3-yl)butanoic acid [ACD/IUPAC Name]
(2S,3R)-2-Hydroxy-3-(1H-indol-3-yl)butansäure [German] [ACD/IUPAC Name]
1H-Indole-3-propanoic acid, α-hydroxy-β-methyl-, (αS,βR)- [ACD/Index Name]
Acide (2S,3R)-2-hydroxy-3-(1H-indol-3-yl)butanoïque [French] [ACD/IUPAC Name]
indolmycenic acid
26622-60-6 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 461.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 232.8±24.6 °C
Index of Refraction: 1.674
Molar Refractivity: 60.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): -0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 67.6±3.0 dyne/cm
Molar Volume: 161.0±3.0 cm3

Click to predict properties on the Chemicalize site


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