ChemSpider 2D Image | 4-(Tetrahydro-2H-thiopyran-4-ylamino)-2-butanol | C9H19NOS

4-(Tetrahydro-2H-thiopyran-4-ylamino)-2-butanol

  • Molecular FormulaC9H19NOS
  • Average mass189.318 Da
  • Monoisotopic mass189.118729 Da
  • ChemSpider ID31037412

More details:

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

2-Butanol, 4-[(tetrahydro-2H-thiopyran-4-yl)amino]- [ACD/Index Name]
4-(Tetrahydro-2H-thiopyran-4-ylamino)-2-butanol [German] [ACD/IUPAC Name]
4-(Tetrahydro-2H-thiopyran-4-ylamino)-2-butanol [ACD/IUPAC Name]
4-(Tétrahydro-2H-thiopyrane-4-ylamino)-2-butanol [French] [ACD/IUPAC Name]
1341641-40-4 [RN]
4-((tetrahydro-2H-thiopyran-4-yl)amino)butan-2-ol
4-[(thian-4-yl)amino]butan-2-ol
MFCD20391294

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

Density: 1.1±0.1 g/cm3
Boiling Point: 329.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.3±6.0 kJ/mol
Flash Point: 152.9±26.5 °C
Index of Refraction: 1.523
Molar Refractivity: 54.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.60
ACD/LogD (pH 5.5): -1.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.84
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 179.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement