Found 384 results

Search term: MF = 'C_{11}H_{12}O_{5}S'
ChemSpider 2D Image | 3-(2,3-dihydro-1,4-benzodioxine-6-sulfinyl)propanoic acid | C11H12O5S

3-(2,3-dihydro-1,4-benzodioxine-6-sulfinyl)propanoic acid

  • Molecular FormulaC11H12O5S
  • Average mass256.275 Da
  • Monoisotopic mass256.040558 Da
  • ChemSpider ID28544387

More details:

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

1334012-17-7 [RN]
3-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfinyl)propanoic acid [ACD/IUPAC Name]
3-(2,3-Dihydro-1,4-benzodioxin-6-ylsulfinyl)propansäure [German] [ACD/IUPAC Name]
3-(2,3-dihydro-1,4-benzodioxine-6-sulfinyl)propanoic acid
Acide 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfinyl)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[(2,3-dihydro-1,4-benzodioxin-6-yl)sulfinyl]- [ACD/Index Name]
MFCD19982359

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

Density: 1.5±0.1 g/cm3
Boiling Point: 507.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 260.5±30.1 °C
Index of Refraction: 1.647
Molar Refractivity: 61.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.30
ACD/LogD (pH 5.5): -0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.37
ACD/LogD (pH 7.4): -2.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 78.6±5.0 dyne/cm
Molar Volume: 170.2±5.0 cm3

Click to predict properties on the Chemicalize site


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