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Search term: XDVAOWPOJWYAHA (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1-ethynylcyclopropanecarboxylic acid | C6H6O2

1-ethynylcyclopropanecarboxylic acid

  • Molecular FormulaC6H6O2
  • Average mass110.111 Da
  • Monoisotopic mass110.036781 Da
  • ChemSpider ID28294773

More details:






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

1-Ethinylcyclopropancarbonsäure [German] [ACD/IUPAC Name]
Acide 1-éthynylcyclopropanecarboxylique [French] [ACD/IUPAC Name]
1-Ethynylcyclopropane carboxylic acid
1-ETHYNYLCYCLOPROPANE-1-CARBOXYLIC ACID
1-Ethynylcyclopropanecarboxylic acid [ACD/IUPAC Name]
1-ethynylcyclopropanecarboxylicacid
933755-97-6 [RN]
Cyclopropanecarboxylic acid, 1-ethynyl- [ACD/Index Name]
ethynylcyclopropanecarboxylic
MFCD19231569

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 195.1±19.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.8 mmHg at 25°C
Enthalpy of Vaporization: 47.5±6.0 kJ/mol
Flash Point: 86.4±16.2 °C
Index of Refraction: 1.524
Molar Refractivity: 27.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.18
ACD/LogD (pH 5.5): -1.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 10.8±0.5 10-24cm3
Surface Tension: 51.5±5.0 dyne/cm
Molar Volume: 89.1±5.0 cm3

Click to predict properties on the Chemicalize site






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