ChemSpider 2D Image | 2,4,4-Trimethoxy-1-butanamine | C7H17NO3

2,4,4-Trimethoxy-1-butanamine

  • Molecular FormulaC7H17NO3
  • Average mass163.215 Da
  • Monoisotopic mass163.120850 Da
  • ChemSpider ID28467417

More details:

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

1370360-21-6 [RN]
1-Butanamine, 2,4,4-trimethoxy- [ACD/Index Name]
2,4,4-Trimethoxy-1-butanamin [German] [ACD/IUPAC Name]
2,4,4-Trimethoxy-1-butanamine [ACD/IUPAC Name]
2,4,4-Triméthoxy-1-butanamine [French] [ACD/IUPAC Name]
2,4,4-Trimethoxybutan-1-amine
MFCD22575234 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 211.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.7±3.0 kJ/mol
Flash Point: 75.5±21.0 °C
Index of Refraction: 1.429
Molar Refractivity: 43.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.16
ACD/LogD (pH 5.5): -2.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.10
Polar Surface Area: 54 Å2
Polarizability: 17.1±0.5 10-24cm3
Surface Tension: 30.4±3.0 dyne/cm
Molar Volume: 167.6±3.0 cm3

Click to predict properties on the Chemicalize site


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