ChemSpider 2D Image | 4'-(tert-Butyl)-2-methyl-[1,1'-biphenyl]-4-carboxylic acid | C18H20O2

4'-(tert-Butyl)-2-methyl-[1,1'-biphenyl]-4-carboxylic acid

  • Molecular FormulaC18H20O2
  • Average mass268.350 Da
  • Monoisotopic mass268.146332 Da
  • ChemSpider ID26530596

More details:






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

[1,1'-Biphenyl]-4-carboxylic acid, 4'-(1,1-dimethylethyl)-2-methyl- [ACD/Index Name]
1261923-72-1 [RN]
2-Methyl-4'-(2-methyl-2-propanyl)-4-biphenylcarbonsäure [German] [ACD/IUPAC Name]
2-Methyl-4'-(2-methyl-2-propanyl)-4-biphenylcarboxylic acid [ACD/IUPAC Name]
4'-(tert-Butyl)-2-methyl-[1,1'-biphenyl]-4-carboxylic acid
Acide 2-méthyl-4'-(2-méthyl-2-propanyl)-4-biphénylcarboxylique [French] [ACD/IUPAC Name]
[1261923-72-1] [RN]
3-METHYL-4-(4-T-BUTYLPHENYL)BENZOIC ACID
3-Methyl-4-(4-t-butylphenyl)benzoicacid
4'-tert-Butyl-2-methyl[1,1'-biphenyl]-4-carboxylic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 389.8±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.4±3.0 kJ/mol
Flash Point: 186.0±16.7 °C
Index of Refraction: 1.561
Molar Refractivity: 81.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.90
ACD/LogD (pH 5.5): 4.70
ACD/BCF (pH 5.5): 1111.87
ACD/KOC (pH 5.5): 2350.62
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 28.16
ACD/KOC (pH 7.4): 59.53
Polar Surface Area: 37 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 250.2±3.0 cm3

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