ChemSpider 2D Image | (2R,5R)-5-Ethyl-2-isobutyl-4-methyl-2,5-dihydro-1,3-thiazole | C10H19NS

(2R,5R)-5-Ethyl-2-isobutyl-4-methyl-2,5-dihydro-1,3-thiazole

  • Molecular FormulaC10H19NS
  • Average mass185.330 Da
  • Monoisotopic mass185.123825 Da
  • ChemSpider ID32700601

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,5R)-5-Ethyl-2-isobutyl-4-methyl-2,5-dihydro-1,3-thiazol [German] [ACD/IUPAC Name]
(2R,5R)-5-Ethyl-2-isobutyl-4-methyl-2,5-dihydro-1,3-thiazole [ACD/IUPAC Name]
(2R,5R)-5-Éthyl-2-isobutyl-4-méthyl-2,5-dihydro-1,3-thiazole [French] [ACD/IUPAC Name]
192997-61-8 [RN]
Thiazole, 5-ethyl-2,5-dihydro-4-methyl-2-(2-methylpropyl)-, (2R,5R)- [ACD/Index Name]
trans-5-ethyl-2,5-dihydro-4-methyl-2-(2-methylpropyl)-thiazole
5-ETHYL-2,5-DIHYDRO-4-METHYL-2-(2-METHYLPROPYL)-THIAZOLE
5-Ethyl-2,5-dihydro-4-methyl-2-(2-methylpropyl)-thiazole, (E)-
5-ETHYL-2,5-DIHYDRO-4-METHYL-2-(2-METHYLPROPYL)-THIAZOLE, TRANS-
83418-53-5 [RN]
More...

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

OB239EA69G [DBID]
UNII:OB239EA69G [DBID]
UNII-OB239EA69G [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 252.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.0±3.0 kJ/mol
Flash Point: 106.7±25.4 °C
Index of Refraction: 1.534
Molar Refractivity: 56.2±0.5 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.48
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 30.48
ACD/KOC (pH 5.5): 163.26
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 528.13
ACD/KOC (pH 7.4): 2829.10
Polar Surface Area: 38 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 30.6±7.0 dyne/cm
Molar Volume: 180.7±7.0 cm3

Click to predict properties on the Chemicalize site


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