ChemSpider 2D Image | 5-[(2R)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-2-yl]-2-methylpentanoic acid | C19H28O4

5-[(2R)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-2-yl]-2-methylpentanoic acid

  • Molecular FormulaC19H28O4
  • Average mass320.423 Da
  • Monoisotopic mass320.198761 Da
  • ChemSpider ID35032548

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

2H-1-Benzopyran-2-pentanoic acid, 3,4-dihydro-6-hydroxy-α,2,5,7,8-pentamethyl-, (2R)- [ACD/Index Name]
5-[(2R)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-2-yl]-2-methylpentanoic acid [ACD/IUPAC Name]
5-[(2R)-6-Hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromen-2-yl]-2-methylpentansäure [German] [ACD/IUPAC Name]
Acide 5-[(2R)-6-hydroxy-2,5,7,8-tétraméthyl-3,4-dihydro-2H-chromén-2-yl]-2-méthylpentanoïque [French] [ACD/IUPAC Name]
2-(4-Carboxy-4-methylbutyl)-6-hydroxy-2,5,7,8-tetramethylchroman
5-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-1-benzopyran-2-yl]-2-methylpentanoic acid
5-[(2R)-6-hydroxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2-methylpentanoic acid
5'-Carboxy-α-chromanol
5'-Carboxy-α-tocopherol
α- Carboxymethylbutyl-hydroxychroman
More...

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 499.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.8±3.0 kJ/mol
Flash Point: 174.6±22.2 °C
Index of Refraction: 1.532
Molar Refractivity: 90.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 3.85
ACD/BCF (pH 5.5): 318.86
ACD/KOC (pH 5.5): 1280.88
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 5.11
ACD/KOC (pH 7.4): 20.55
Polar Surface Area: 67 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 291.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement