Found 3 results

Search term: IUADYGVMSDKSMB (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2R)-4-Methyl-1-phenyl-2-pentanol | C12H18O

(2R)-4-Methyl-1-phenyl-2-pentanol

  • Molecular FormulaC12H18O
  • Average mass178.271 Da
  • Monoisotopic mass178.135757 Da
  • ChemSpider ID34996071

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-4-Methyl-1-phenyl-2-pentanol [German] [ACD/IUPAC Name]
(2R)-4-Methyl-1-phenyl-2-pentanol [ACD/IUPAC Name]
(2R)-4-Méthyl-1-phényl-2-pentanol [French] [ACD/IUPAC Name]
Benzeneethanol, α-(2-methylpropyl)-, (αR)- [ACD/Index Name]
231-939-6 [EINECS]
7779-78-4 [RN]
UNII-2SBL0E1I0N
α-ISOBUTYLPHENETHYL ALCOHOL

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

Density: 1.0±0.1 g/cm3
Boiling Point: 198.3±8.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.9±3.0 kJ/mol
Flash Point: 79.4±8.9 °C
Index of Refraction: 1.510
Molar Refractivity: 55.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 95.02
ACD/KOC (pH 5.5): 906.43
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 95.02
ACD/KOC (pH 7.4): 906.43
Polar Surface Area: 20 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 35.2±3.0 dyne/cm
Molar Volume: 186.5±3.0 cm3

Click to predict properties on the Chemicalize site


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