ChemSpider 2D Image | (2S)-2,6-Diamino-1-hexanethiol | C6H16N2S

(2S)-2,6-Diamino-1-hexanethiol

  • Molecular FormulaC6H16N2S
  • Average mass148.270 Da
  • Monoisotopic mass148.103424 Da
  • ChemSpider ID25031799

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2,6-Diamino-1-hexanethiol [ACD/IUPAC Name]
(2S)-2,6-Diamino-1-hexanethiol [French] [ACD/IUPAC Name]
(2S)-2,6-Diamino-1-hexanthiol [German] [ACD/IUPAC Name]
1-Hexanethiol, 2,6-diamino-, (2S)- [ACD/Index Name]
110675-37-1 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 258.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.6±3.0 kJ/mol
Flash Point: 110.1±24.6 °C
Index of Refraction: 1.511
Molar Refractivity: 44.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.02
ACD/LogD (pH 5.5): -4.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 91 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 149.4±3.0 cm3

Click to predict properties on the Chemicalize site


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