ChemSpider 2D Image | Ethyl 4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl]-4-oxobutanoate | C20H27NO5

Ethyl 4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl]-4-oxobutanoate

  • Molecular FormulaC20H27NO5
  • Average mass361.432 Da
  • Monoisotopic mass361.188934 Da
  • ChemSpider ID21400117

More details:

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

4-[2-(1,4-Dioxa-8-azaspiro[4.5]déc-8-ylméthyl)phényl]-4-oxobutanoate d'éthyle [French] [ACD/IUPAC Name]
898781-23-2 [RN]
Benzenebutanoic acid, 2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-γ-oxo-, ethyl ester [ACD/Index Name]
Ethyl 4-(2-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)phenyl)-4-oxobutanoate
Ethyl 4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl]-4-oxobutanoate [ACD/IUPAC Name]
Ethyl-4-[2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)phenyl]-4-oxobutanoat [German] [ACD/IUPAC Name]
ethyl 4-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylmethyl)phenyl]-4-oxobutanoate
ethyl 4-[2-[8-(1,4-dioxa-8-azaspiro[4.5]decyl)methyl]phenyl]-4-oxobutyrate
Ethyl 4-[2-[8-(1,4-dioxa-8-azaspiro-[4.5]decyl)methyl]phenyl]-4-oxobutyrate
Ethyl 4-{2-[(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methyl]phenyl}-4-oxobutanoate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 506.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 259.9±30.1 °C
Index of Refraction: 1.558
Molar Refractivity: 96.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.46
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.32
ACD/LogD (pH 7.4): 2.54
ACD/BCF (pH 7.4): 23.53
ACD/KOC (pH 7.4): 135.25
Polar Surface Area: 65 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 49.9±5.0 dyne/cm
Molar Volume: 300.2±5.0 cm3

Click to predict properties on the Chemicalize site


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