ChemSpider 2D Image | (2,3-Dihydro-1H-inden-2-ylsulfanyl)acetic acid | C11H12O2S

(2,3-Dihydro-1H-inden-2-ylsulfanyl)acetic acid

  • Molecular FormulaC11H12O2S
  • Average mass208.277 Da
  • Monoisotopic mass208.055801 Da
  • ChemSpider ID28600287

More details:

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

(2,3-Dihydro-1H-inden-2-ylsulfanyl)acetic acid [ACD/IUPAC Name]
(2,3-Dihydro-1H-inden-2-ylsulfanyl)essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[(2,3-dihydro-1H-inden-2-yl)thio]- [ACD/Index Name]
Acide (2,3-dihydro-1H-indén-2-ylsulfanyl)acétique [French] [ACD/IUPAC Name]
(2,3-dihydro-1H-inden-2-ylthio)acetic acid
[(2,3-Dihydro-1H-inden-2-yl)sulfanyl]acetic acid
14091-22-6 [RN]
2-((2,3-Dihydro-1H-inden-2-yl)thio)acetic acid
2-((2,3-Dihydro-1H-inden-2-yl)thio)aceticacid
2-(2,3-dihydro-1H-inden-2-ylthio)acetic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 387.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 67.1±3.0 kJ/mol
Flash Point: 188.1±27.9 °C
Index of Refraction: 1.626
Molar Refractivity: 57.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 1.49
ACD/KOC (pH 5.5): 15.19
ACD/LogD (pH 7.4): -0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 56.5±5.0 dyne/cm
Molar Volume: 162.4±5.0 cm3

Click to predict properties on the Chemicalize site


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