Found 53 results

Search term: MF = 'C_{12}H_{17}IO_{3}'
ChemSpider 2D Image | Ethyl 4-(iodomethyl)-3-oxaspiro[bicyclo[2.1.1]hexane-2,1'-cyclobutane]-1-carboxylate | C12H17IO3

Ethyl 4-(iodomethyl)-3-oxaspiro[bicyclo[2.1.1]hexane-2,1'-cyclobutane]-1-carboxylate

  • Molecular FormulaC12H17IO3
  • Average mass336.166 Da
  • Monoisotopic mass336.022217 Da
  • ChemSpider ID65682525

More details:

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

Ethyl 4-(iodomethyl)-3-oxaspiro[bicyclo[2.1.1]hexane-2,1'-cyclobutane]-1-carboxylate [ACD/IUPAC Name]
Spiro[cyclobutane-1,3'-[2]oxabicyclo[2.1.1]hexane]-4'-carboxylic acid, 1'-(iodomethyl)-, ethyl ester [ACD/Index Name]
MFCD31665501

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

Density: 1.7±0.1 g/cm3
Boiling Point: 350.7±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 165.9±19.6 °C
Index of Refraction: 1.591
Molar Refractivity: 68.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 2.88
ACD/BCF (pH 5.5): 91.59
ACD/KOC (pH 5.5): 882.87
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 91.59
ACD/KOC (pH 7.4): 882.87
Polar Surface Area: 36 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 49.0±5.0 dyne/cm
Molar Volume: 201.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement