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Search term: PHTCHNXMZNENAI (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (2-Isopropyl-5-methylphenyl)acetic acid | C12H16O2

(2-Isopropyl-5-methylphenyl)acetic acid

  • Molecular FormulaC12H16O2
  • Average mass192.254 Da
  • Monoisotopic mass192.115036 Da
  • ChemSpider ID60747836

More details:






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

(2-Isopropyl-5-methylphenyl)acetic acid [ACD/IUPAC Name]
(2-Isopropyl-5-methylphenyl)essigsäure [German] [ACD/IUPAC Name]
Acide (2-isopropyl-5-méthylphényl)acétique [French] [ACD/IUPAC Name]
Benzeneacetic acid, 5-methyl-2-(1-methylethyl)- [ACD/Index Name]
1379287-54-3 [RN]
MFCD20652085

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

Density: 1.0±0.1 g/cm3
Boiling Point: 300.7±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.1±3.0 kJ/mol
Flash Point: 197.8±14.4 °C
Index of Refraction: 1.528
Molar Refractivity: 56.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 14.96
ACD/KOC (pH 5.5): 108.05
ACD/LogD (pH 7.4): 0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.76
Polar Surface Area: 37 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 183.2±3.0 cm3

Click to predict properties on the Chemicalize site






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