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Search term: MF = 'C_{21}H_{29}NO_{6}'
ChemSpider 2D Image | 3-[(3,4-Dimethoxybenzyl)(2-furylmethyl)amino]-2-hydroxypropyl butyrate | C21H29NO6

3-[(3,4-Dimethoxybenzyl)(2-furylmethyl)amino]-2-hydroxypropyl butyrate

  • Molecular FormulaC21H29NO6
  • Average mass391.458 Da
  • Monoisotopic mass391.199493 Da
  • ChemSpider ID22624849

More details:

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

3-[(3,4-Dimethoxybenzyl)(2-furylmethyl)amino]-2-hydroxypropyl butyrate [ACD/IUPAC Name]
3-[(3,4-Dimethoxybenzyl)(2-furylmethyl)amino]-2-hydroxypropylbutyrat [German] [ACD/IUPAC Name]
Butanoic acid, 3-[[(3,4-dimethoxyphenyl)methyl](2-furanylmethyl)amino]-2-hydroxypropyl ester [ACD/Index Name]
Butyrate de 3-[(3,4-diméthoxybenzyl)(2-furylméthyl)amino]-2-hydroxypropyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 529.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 274.2±30.1 °C
Index of Refraction: 1.536
Molar Refractivity: 105.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 26.98
ACD/KOC (pH 5.5): 246.00
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 107.22
ACD/KOC (pH 7.4): 977.44
Polar Surface Area: 81 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 337.9±3.0 cm3

Click to predict properties on the Chemicalize site


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