ChemSpider 2D Image | (2R,3S)-1-(4-Chlorophenyl)-4-(dimethylamino)-2,3-dimethyl-2-butanol | C14H22ClNO

(2R,3S)-1-(4-Chlorophenyl)-4-(dimethylamino)-2,3-dimethyl-2-butanol

  • Molecular FormulaC14H22ClNO
  • Average mass255.784 Da
  • Monoisotopic mass255.138992 Da
  • ChemSpider ID32809841

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3S)-1-(4-Chlorophenyl)-4-(dimethylamino)-2,3-dimethyl-2-butanol [ACD/IUPAC Name]
(2R,3S)-1-(4-Chlorophényl)-4-(diméthylamino)-2,3-diméthyl-2-butanol [French] [ACD/IUPAC Name]
(2R,3S)-1-(4-Chlorphenyl)-4-(dimethylamino)-2,3-dimethyl-2-butanol [German] [ACD/IUPAC Name]
Benzeneethanol, 4-chloro-α-[(1S)-2-(dimethylamino)-1-methylethyl]-α-methyl-, (αR)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 356.8±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 169.6±25.1 °C
Index of Refraction: 1.530
Molar Refractivity: 73.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.89
ACD/LogD (pH 5.5): 0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.13
ACD/LogD (pH 7.4): 1.09
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 10.42
Polar Surface Area: 23 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 238.4±3.0 cm3

Click to predict properties on the Chemicalize site


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