ChemSpider 2D Image | Fluoro(5-nitro-2-thienyl)acetic acid | C6H4FNO4S

Fluoro(5-nitro-2-thienyl)acetic acid

  • Molecular FormulaC6H4FNO4S
  • Average mass205.164 Da
  • Monoisotopic mass204.984512 Da
  • ChemSpider ID44788530

More details:

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

2-Thiopheneacetic acid, α-fluoro-5-nitro- [ACD/Index Name]
Acide fluoro(5-nitro-2-thiényl)acétique [French] [ACD/IUPAC Name]
Fluor(5-nitro-2-thienyl)essigsäure [German] [ACD/IUPAC Name]
Fluoro(5-nitro-2-thienyl)acetic acid [ACD/IUPAC Name]
1557626-68-2 [RN]
MFCD26743419

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

Density: 1.6±0.1 g/cm3
Boiling Point: 373.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 179.6±27.9 °C
Index of Refraction: 1.598
Molar Refractivity: 42.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): -2.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 111 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 64.5±3.0 dyne/cm
Molar Volume: 124.4±3.0 cm3

Click to predict properties on the Chemicalize site


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