ChemSpider 2D Image | (2-Hydroxyethyl)propylcarbamodithioic acid | C6H13NOS2

(2-Hydroxyethyl)propylcarbamodithioic acid

  • Molecular FormulaC6H13NOS2
  • Average mass179.303 Da
  • Monoisotopic mass179.043854 Da
  • ChemSpider ID28708405

More details:

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

(2-Hydroxyethyl)propylcarbamodithioic acid [ACD/IUPAC Name]
(2-Hydroxyethyl)propylcarbamodithiosäure [German] [ACD/IUPAC Name]
Acide (2-hydroxyéthyl)propylcarbamodithioïque [French] [ACD/IUPAC Name]
Carbamodithioic acid, N-(2-hydroxyethyl)-N-propyl- [ACD/Index Name]
91487-43-3 [RN]
CARBAMODITHIOIC ACID, (2-HYDROXYETHYL)PROPYL-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 263.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.2±6.0 kJ/mol
Flash Point: 112.9±27.9 °C
Index of Refraction: 1.579
Molar Refractivity: 50.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): -1.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 94 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 151.4±3.0 cm3

Click to predict properties on the Chemicalize site


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