ChemSpider 2D Image | cis-1-{[(2,5-Dimethylphenyl)(hydroxy)acetyl]amino}-4-methoxycyclohexanecarboxylic acid | C18H25NO5

cis-1-{[(2,5-Dimethylphenyl)(hydroxy)acetyl]amino}-4-methoxycyclohexanecarboxylic acid

  • Molecular FormulaC18H25NO5
  • Average mass335.395 Da
  • Monoisotopic mass335.173279 Da
  • ChemSpider ID71048357

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

Acide cis-1-{[2-(2,5-diméthylphényl)-2-hydroxyacétyl]amino}-4-méthoxycyclohexanecarboxylique [French] [ACD/IUPAC Name]
cis-1-{[(2,5-Dimethylphenyl)(hydroxy)acetyl]amino}-4-methoxycyclohexancarbonsäure [German] [ACD/IUPAC Name]
cis-1-{[(2,5-Dimethylphenyl)(hydroxy)acetyl]amino}-4-methoxycyclohexanecarboxylic acid [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 1-[[2-(2,5-dimethylphenyl)-2-hydroxyacetyl]amino]-4-methoxy-, cis- [ACD/Index Name]
Spirotetramat-MA-amide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 586.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 308.6±30.1 °C
Index of Refraction: 1.570
Molar Refractivity: 88.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): -0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.68
ACD/LogD (pH 7.4): -1.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 54.4±5.0 dyne/cm
Molar Volume: 271.2±5.0 cm3

Click to predict properties on the Chemicalize site


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