Molecular Structure of 2-(2,5-Difluorophenyl)cyclopropanecarboxylic acid (CAS No.1157698-34-4):
Molecular Formula: C10H8F2O2
Molecular Weight: 198.1661
CAS No: 1157698-34-4
Systematic Name: 2-(2,5-Difluorophenyl)cyclopropanecarboxylic acid
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 37.3 Å2
Index of Refraction: 1.556
Molar Refractivity: 44.374 cm3
Molar Volume: 138.092 cm3
Surface Tension: 49.99 dyne/cm
Density: 1.435 g/cm3
Flash Point: 126.567 °C
Enthalpy of Vaporization: 55.421 kJ/mol
Boiling Point: 285.666 °C at 760 mmHg
Vapour Pressure: 0.001 mmHg at 25°C
InChI: InChI=1/C10H8F2O2/c11-5-1-2-9(12)7(3-5)6-4-8(6)10(13)14/h1-3,6,8H,4H2,(H,13,14)
InChIKey: JBZJYHGCTGBDMR-UHFFFAOYAG
Std. InChI: InChI=1S/C10H8F2O2/c11-5-1-2-9(12)7(3-5)6-4-8(6)10(13)14/h1-3,6,8H,4H2,(H,13,14)
Std. InChIKey: JBZJYHGCTGBDMR-UHFFFAOYSA-N
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