ChemSpider 2D Image | 3-Butyl-2,4-dimethyl-1H-pyrrole | C10H17N

3-Butyl-2,4-dimethyl-1H-pyrrole

  • Molecular FormulaC10H17N
  • Average mass151.249 Da
  • Monoisotopic mass151.136093 Da
  • ChemSpider ID14220646

More details:

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

151464-91-4 [RN]
1H-Pyrrole, 3-butyl-2,4-dimethyl- [ACD/Index Name]
3-Butyl-2,4-dimethyl-1H-pyrrol [German] [ACD/IUPAC Name]
3-Butyl-2,4-dimethyl-1H-pyrrole [ACD/IUPAC Name]
3-Butyl-2,4-diméthyl-1H-pyrrole [French] [ACD/IUPAC Name]
3-tert-butyl-2,4-dimethylpyrrole
[151464-91-4] [RN]
2,4-Dimethyl-3-butylpyrrole
3-BUTYL-2,4-DIMETHYL PYRROLE
MFCD08458287 [MDL number]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 238.2±9.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 45.6±3.0 kJ/mol
Flash Point: 94.0±10.0 °C
Index of Refraction: 1.503
Molar Refractivity: 49.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 615.12
ACD/KOC (pH 5.5): 3435.63
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 624.72
ACD/KOC (pH 7.4): 3489.22
Polar Surface Area: 16 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 33.0±3.0 dyne/cm
Molar Volume: 166.1±3.0 cm3

Click to predict properties on the Chemicalize site


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