Found 2644 results

Search term: MF = 'C_{13}H_{17}ClO_{3}'
ChemSpider 2D Image | 5-Chloro-1-(3,4-dimethoxyphenyl)-1-pentanone | C13H17ClO3

5-Chloro-1-(3,4-dimethoxyphenyl)-1-pentanone

  • Molecular FormulaC13H17ClO3
  • Average mass256.725 Da
  • Monoisotopic mass256.086609 Da
  • ChemSpider ID21401540

More details:

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

1-Pentanone, 5-chloro-1-(3,4-dimethoxyphenyl)- [ACD/Index Name]
33245-77-1 [RN]
5-Chlor-1-(3,4-dimethoxyphenyl)-1-pentanon [German] [ACD/IUPAC Name]
5-Chloro-1-(3,4-dimethoxyphenyl)-1-pentanone [ACD/IUPAC Name]
5-Chloro-1-(3,4-diméthoxyphényl)-1-pentanone [French] [ACD/IUPAC Name]
1-Chloro-5-(3,4-dimethoxyphenyl)-5-oxopentane
5-chloro-1-(3,4-dimethoxyphenyl)pentan-1-one
95%
MFCD07700116 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 383.7±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.2±3.0 kJ/mol
Flash Point: 152.8±24.1 °C
Index of Refraction: 1.507
Molar Refractivity: 68.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 2.93
ACD/BCF (pH 5.5): 98.72
ACD/KOC (pH 5.5): 931.57
ACD/LogD (pH 7.4): 2.93
ACD/BCF (pH 7.4): 98.72
ACD/KOC (pH 7.4): 931.57
Polar Surface Area: 36 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 229.9±3.0 cm3

Click to predict properties on the Chemicalize site


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