Found 4517 results

Search term: MF = 'C_{16}H_{21}ClN_{4}O'
ChemSpider 2D Image | 6-Butoxy-2-chloro-5,5-diethyl-5,6-dihydro-3,4,4(1H)-pyridinetricarbonitrile | C16H21ClN4O

6-Butoxy-2-chloro-5,5-diethyl-5,6-dihydro-3,4,4(1H)-pyridinetricarbonitrile

  • Molecular FormulaC16H21ClN4O
  • Average mass320.817 Da
  • Monoisotopic mass320.140381 Da
  • ChemSpider ID21593860

More details:

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

3,4,4(1H)-Pyridinetricarbonitrile, 6-butoxy-2-chloro-5,5-diethyl-5,6-dihydro- [ACD/Index Name]
6-Butoxy-2-chlor-5,5-diethyl-5,6-dihydro-3,4,4(1H)-pyridintricarbonitril [German] [ACD/IUPAC Name]
6-Butoxy-2-chloro-5,5-diethyl-5,6-dihydro-3,4,4(1H)-pyridinetricarbonitrile [ACD/IUPAC Name]
6-Butoxy-2-chloro-5,5-diéthyl-5,6-dihydro-3,4,4(1H)-pyridinetricarbonitrile [French] [ACD/IUPAC Name]
6-butoxy-2-chloro-5,5-diethyl-1,4,5,6-tetrahydropyridine-3,4,4-tricarbonitrile
6-butoxy-2-chloro-5,5-diethyl-5,6-dihydropyridine-3,4,4(1H)-tricarbonitrile

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

Density: 1.2±0.1 g/cm3
Boiling Point: 494.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.6±28.7 °C
Index of Refraction: 1.521
Molar Refractivity: 83.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.84
ACD/LogD (pH 5.5): 4.03
ACD/BCF (pH 5.5): 675.72
ACD/KOC (pH 5.5): 3691.04
ACD/LogD (pH 7.4): 4.03
ACD/BCF (pH 7.4): 675.72
ACD/KOC (pH 7.4): 3691.04
Polar Surface Area: 93 Å2
Polarizability: 33.1±0.5 10-24cm3
Surface Tension: 49.5±5.0 dyne/cm
Molar Volume: 274.4±5.0 cm3

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