ChemSpider 2D Image | 6-Chloro-2,4-hexadiyn-1-amine | C6H6ClN

6-Chloro-2,4-hexadiyn-1-amine

  • Molecular FormulaC6H6ClN
  • Average mass127.572 Da
  • Monoisotopic mass127.018875 Da
  • ChemSpider ID32982085

More details:






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

2,4-Hexadiyn-1-amine, 6-chloro- [ACD/Index Name]
6-Chlor-2,4-hexadiin-1-amin [German] [ACD/IUPAC Name]
6-Chloro-2,4-hexadiyn-1-amine [ACD/IUPAC Name]
6-Chloro-2,4-hexadiyn-1-amine [French] [ACD/IUPAC Name]
80237-64-5 [RN]
MFCD19209889

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 236.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.3±3.0 kJ/mol
Flash Point: 96.7±23.2 °C
Index of Refraction: 1.539
Molar Refractivity: 34.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): 0.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.75
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 6.63
ACD/KOC (pH 7.4): 120.71
Polar Surface Area: 26 Å2
Polarizability: 13.6±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 109.2±3.0 cm3

Click to predict properties on the Chemicalize site






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