ChemSpider 2D Image | 1'-Benzyl-6-chlorospiro[chroman-2,4'-piperidin]-4-one | C20H20ClNO2

1'-Benzyl-6-chlorospiro[chroman-2,4'-piperidin]-4-one

  • Molecular FormulaC20H20ClNO2
  • Average mass341.831 Da
  • Monoisotopic mass341.118256 Da
  • ChemSpider ID11348303

More details:

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

1'-Benzyl-6-chlorospiro[chroman-2,4'-piperidin]-4-one
1'-Benzyl-6-chlorospiro[chromene-2,4'-piperidin]-4(3H)-one [ACD/IUPAC Name]
1'-Benzyl-6-chlorospiro[chromene-2,4'-piperidin]-4(3H)-one [French] [ACD/IUPAC Name]
1'-Benzyl-6-chlorspiro[chromene-2,4'-piperidin]-4(3H)-on [German] [ACD/IUPAC Name]
81122-68-1 [RN]
Spiro[2H-1-benzopyran-2,4'-piperidin]-4(3H)-one, 6-chloro-1'-(phenylmethyl)- [ACD/Index Name]
1'-benzyl-6-chlorospiro[chromane-2,4'-piperidin]-4-one
1-benzyl-6-chlorospiro[chromene-2,4-piperidin]-4(3h)-one
MFCD22741776

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

Density: 1.3±0.1 g/cm3
Boiling Point: 495.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.6±28.7 °C
Index of Refraction: 1.639
Molar Refractivity: 95.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 4.60
ACD/KOC (pH 5.5): 18.34
ACD/LogD (pH 7.4): 3.68
ACD/BCF (pH 7.4): 213.74
ACD/KOC (pH 7.4): 852.13
Polar Surface Area: 30 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 56.2±5.0 dyne/cm
Molar Volume: 263.9±5.0 cm3

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