Molecular Structure of 3-Fluoro-4-morpholin-4-ylbenzaldehyde (CAS No.495404-90-5):
Molecular Formula: C11H12FNO2
Molecular Weight: 209.2169
CAS No: 495404-90-5
H bond acceptors: 3
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 29.54 Å2
Index of Refraction: 1.563
Molar Refractivity: 54.8 cm3
Molar Volume: 168.6 cm3
Surface Tension: 44.5 dyne/cm
Density: 1.24 g/cm3
Flash Point: 169.7 °C
Enthalpy of Vaporization: 60.23 kJ/mol
Boiling Point: 357 °C at 760 mmHg
Vapour Pressure: 2.81E-05 mmHg at 25°C
Systematic Name: 3-Fluoro-4-morpholin-4-ylbenzaldehyde
InChI: InChI=1/C11H12FNO2/c12-10-7-9(8-14)1-2-11(10)13-3-5-15-6-4-13/h1-2,7-8H,3-6H2
InChIKey: RYBHUGMTHMMHKH-UHFFFAOYAG
Std. InChI: InChI=1S/C11H12FNO2/c12-10-7-9(8-14)1-2-11(10)13-3-5-15-6-4-13/h1-2,7-8H,3-6H2
Std. InChIKey: RYBHUGMTHMMHKH-UHFFFAOYSA-N
Hazard Codes: Xi
HazardClass: IRRITANT
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