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Search term: HCACPVKQRHNREB (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1-(Dimethylamino)-2-(hydroxymethyl)-1,3-propanediol | C6H15NO3

1-(Dimethylamino)-2-(hydroxymethyl)-1,3-propanediol

  • Molecular FormulaC6H15NO3
  • Average mass149.188 Da
  • Monoisotopic mass149.105194 Da
  • ChemSpider ID14079647

More details:






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

1-(Dimethylamino)-2-(hydroxymethyl)-1,3-propandiol [German] [ACD/IUPAC Name]
1-(Dimethylamino)-2-(hydroxymethyl)-1,3-propanediol [ACD/IUPAC Name]
1-(Diméthylamino)-2-(hydroxyméthyl)-1,3-propanediol [French] [ACD/IUPAC Name]
1,3-Propanediol, 1-(dimethylamino)-2-(hydroxymethyl)- [ACD/Index Name]
1-(dimethylamino)-2-(hydroxymethyl)propane-1,3-diol
1,3-Propanediol, 1-(dimethylamino)-2-(hydroxymethyl)- (9CI)
740023-70-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 304.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 63.2±6.0 kJ/mol
Flash Point: 170.7±26.5 °C
Index of Refraction: 1.506
Molar Refractivity: 38.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.15
ACD/LogD (pH 5.5): -2.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.18
Polar Surface Area: 64 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 128.1±3.0 cm3

Click to predict properties on the Chemicalize site






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