Found 384 results

Search term: MF = 'C_{11}H_{12}O_{5}S'
ChemSpider 2D Image | Methyl 3-methoxy-2,3-dihydro-1-benzothiophene-3-carboxylate 1,1-dioxide | C11H12O5S

Methyl 3-methoxy-2,3-dihydro-1-benzothiophene-3-carboxylate 1,1-dioxide

  • Molecular FormulaC11H12O5S
  • Average mass256.275 Da
  • Monoisotopic mass256.040558 Da
  • ChemSpider ID21173124

More details:

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

1,1-Dioxyde de 3-méthoxy-2,3-dihydro-1-benzothiophène-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
247-966-1 [EINECS]
Benzo[b]thiophene-3-carboxylic acid, 2,3-dihydro-3-methoxy-, methyl ester, 1,1-dioxide [ACD/Index Name]
Methyl 3-methoxy-2,3-dihydro-1-benzothiophene-3-carboxylate 1,1-dioxide [ACD/IUPAC Name]
Methyl-3-methoxy-2,3-dihydro-1-benzothiophen-3-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
26759-42-2 [RN]
METHYL 3-METHOXY-1,1-DIOXO-2H-1??-BENZOTHIOPHENE-3-CARBOXYLATE
methyl 3-methoxybenzo[b]thiophene-3-carboxylate 1,1-dioxide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 418.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 206.8±28.7 °C
Index of Refraction: 1.574
Molar Refractivity: 60.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.47
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 2.03
ACD/KOC (pH 5.5): 57.70
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 2.03
ACD/KOC (pH 7.4): 57.70
Polar Surface Area: 78 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 53.6±5.0 dyne/cm
Molar Volume: 182.8±5.0 cm3

Click to predict properties on the Chemicalize site


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