ChemSpider 2D Image | (2S)-2-Amino-1,4-butanediol | C4H11NO2

(2S)-2-Amino-1,4-butanediol

  • Molecular FormulaC4H11NO2
  • Average mass105.136 Da
  • Monoisotopic mass105.078979 Da
  • ChemSpider ID22837175

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Amino-1,4-butandiol [German] [ACD/IUPAC Name]
(2S)-2-Amino-1,4-butanediol [ACD/IUPAC Name]
(2S)-2-Amino-1,4-butanediol [French] [ACD/IUPAC Name]
1,4-Butanediol, 2-amino-, (2S)- [ACD/Index Name]
10405-07-9 [RN]
"(2S)-2-AMINOBUTANE-1,4-DIOL"|"(2S)-2-AMINOBUTANE-1,4-DIOL"
(2S)-2-aminobutane-1,4-diol
[10405-07-9] [RN]
2-AMINOBUTANE-1,4-DIOL
MFCD09863824 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 269.4±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.9±6.0 kJ/mol
Flash Point: 116.8±21.8 °C
Index of Refraction: 1.492
Molar Refractivity: 27.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.84
ACD/LogD (pH 5.5): -4.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 10.8±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 93.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement