ChemSpider 2D Image | (S)-lombazole | C22H17ClN2

(S)-lombazole

  • Molecular FormulaC22H17ClN2
  • Average mass344.837 Da
  • Monoisotopic mass344.108032 Da
  • ChemSpider ID34995819

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(S)-lombazole
1-[(S)-4-Biphenylyl(2-chlorophenyl)methyl]-1H-imidazole [ACD/IUPAC Name]
1-[(S)-4-Biphénylyl(2-chlorophényl)méthyl]-1H-imidazole [French] [ACD/IUPAC Name]
1-[(S)-4-Biphenylyl(2-chlorphenyl)methyl]-1H-imidazol [German] [ACD/IUPAC Name]
1H-Imidazole, 1-[(S)-[1,1'-biphenyl]-4-yl(2-chlorophenyl)methyl]- [ACD/Index Name]
262-337-1 [EINECS]
60628-98-0 [RN]
lombazole [BAN] [INN]
LOMBAZOLE, (S)-
UNII-ZHC772U9S3

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

1QB6WF4T5L [DBID]
UNII:1QB6WF4T5L [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 512.7±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 263.9±26.8 °C
Index of Refraction: 1.627
Molar Refractivity: 105.4±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 665.48
ACD/KOC (pH 5.5): 2052.01
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4658.09
ACD/KOC (pH 7.4): 14363.33
Polar Surface Area: 18 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 297.4±7.0 cm3

Click to predict properties on the Chemicalize site


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