ChemSpider 2D Image | (3a,4,5,6,7,7a-~13~C_6_)-1H-Indol-3-ylacetic acid | C413C6H9NO2

(3a,4,5,6,7,7a-13C6)-1H-Indol-3-ylacetic acid

  • Molecular FormulaC413C6H9NO2
  • Average mass181.140 Da
  • Monoisotopic mass181.083466 Da
  • ChemSpider ID48061878
  • Non-standard isotope - Non-standard isotope

More details:

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

(3a,4,5,6,7,7a-13C6)-1H-Indol-3-ylacetic acid [ACD/IUPAC Name]
(3a,4,5,6,7,7a-13C6)-1H-Indol-3-ylessigsäure [German] [ACD/IUPAC Name]
1H-Indole-3a,4,5,6,7,7a-13C6-3-acetic acid [ACD/Index Name]
Acide (3a,4,5,6,7,7a-13C6)-1H-indol-3-ylacétique [French] [ACD/IUPAC Name]
100849-36-3 [RN]
2-(1H-indol-3-yl)acetic acid
Indoleacetic Acid-13C6

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.694
Molar Refractivity: 49.6±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 66.4±3.0 dyne/cm
Molar Volume: 129.3±3.0 cm3

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