ChemSpider 2D Image | Methyl {2-acetyl-5-[(3-methyl-2-buten-1-yl)oxy]phenoxy}acetate | C16H20O5

Methyl {2-acetyl-5-[(3-methyl-2-buten-1-yl)oxy]phenoxy}acetate

  • Molecular FormulaC16H20O5
  • Average mass292.327 Da
  • Monoisotopic mass292.131073 Da
  • ChemSpider ID23499200

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

{2-Acétyl-5-[(3-méthyl-2-butén-1-yl)oxy]phénoxy}acétate de méthyle [French] [ACD/IUPAC Name]
2'-Methoxy carbonyl methoxy-4'-(3-methyl-2-butenyloxy)acetophenone
Acetic acid, 2-[2-acetyl-5-[(3-methyl-2-buten-1-yl)oxy]phenoxy]-, methyl ester [ACD/Index Name]
Methyl {2-acetyl-5-[(3-methyl-2-buten-1-yl)oxy]phenoxy}acetate [ACD/IUPAC Name]
Methyl {2-acetyl-5-[(3-methylbut-2-en-1-yl)oxy]phenoxy}acetate
Methyl-{2-acetyl-5-[(3-methyl-2-buten-1-yl)oxy]phenoxy}acetat [German] [ACD/IUPAC Name]
64506-46-3 [RN]
64506-47-4 [RN]
ACETIC ACID, [2-ACETYL-5-[(3-METHYL-2-BUTENYL)OXY]PHENOXY]-, METHYL ESTER
ACETIC ACID,2-[2-ACETYL-5-[(3-METHYL-2-BUTEN-1-YL)OXY]PHENOXY]-, METHYL ESTER
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 418.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 215.9±13.9 °C
Index of Refraction: 1.509
Molar Refractivity: 79.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.99
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 64.66
ACD/KOC (pH 5.5): 688.12
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 64.66
ACD/KOC (pH 7.4): 688.12
Polar Surface Area: 62 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 264.9±3.0 cm3

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