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Search term: MF = 'C_{15}H_{21}ClO'

ChemSpider 2D Image | 5-(4-Chlorophenyl)-2,2,5-trimethyl-3-hexanone | C15H21ClO

5-(4-Chlorophenyl)-2,2,5-trimethyl-3-hexanone

  • Molecular FormulaC15H21ClO
  • Average mass252.780 Da
  • Monoisotopic mass252.128098 Da
  • ChemSpider ID57501475

More details:






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

3-Hexanone, 5-(4-chlorophenyl)-2,2,5-trimethyl- [ACD/Index Name]
5-(4-Chlorophenyl)-2,2,5-trimethyl-3-hexanone [ACD/IUPAC Name]
5-(4-Chlorophényl)-2,2,5-triméthyl-3-hexanone [French] [ACD/IUPAC Name]
5-(4-Chlorphenyl)-2,2,5-trimethyl-3-hexanon [German] [ACD/IUPAC Name]
5-(4-Chlorophenyl)-2,2,5-trimethylhexan-3-one
88091-28-5 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 319.4±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.1±3.0 kJ/mol
Flash Point: 206.7±12.1 °C
Index of Refraction: 1.499
Molar Refractivity: 72.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 1586.91
ACD/KOC (pH 5.5): 6800.68
ACD/LogD (pH 7.4): 4.51
ACD/BCF (pH 7.4): 1586.91
ACD/KOC (pH 7.4): 6800.68
Polar Surface Area: 17 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 32.2±3.0 dyne/cm
Molar Volume: 247.8±3.0 cm3

Click to predict properties on the Chemicalize site






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