ChemSpider 2D Image | (2R)-2-Amino-4-methyl-1-pentanethiol | C6H15NS

(2R)-2-Amino-4-methyl-1-pentanethiol

  • Molecular FormulaC6H15NS
  • Average mass133.255 Da
  • Monoisotopic mass133.092514 Da
  • ChemSpider ID18831492
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2R)-2-Amino-4-methyl-1-pentanethiol [ACD/IUPAC Name]
(2R)-2-Amino-4-méthyl-1-pentanethiol [French] [ACD/IUPAC Name]
(2R)-2-Amino-4-methyl-1-pentanthiol [German] [ACD/IUPAC Name]
1-Pentanethiol, 2-amino-4-methyl-, (2R)- [ACD/Index Name]
(2R)-2-amino-4-methylpentane-1-thiol
2-Amino-4-methyl-pentane-1-thiol
97231-27-1 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 181.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.8±3.0 kJ/mol
Flash Point: 63.8±22.6 °C
Index of Refraction: 1.476
Molar Refractivity: 41.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.79
ACD/LogD (pH 5.5): -1.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 65 Å2
Polarizability: 16.3±0.5 10-24cm3
Surface Tension: 31.7±3.0 dyne/cm
Molar Volume: 146.1±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement