Chemical Properties of m-Fluoroanisole (CAS 456-49-5)

m-Fluoroanisole

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InChI
InChI=1S/C7H7FO/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3
InChI Key
MFJNOXOAIFNSBX-UHFFFAOYSA-N
Formula
C7H7FO
SMILES
COc1cccc(F)c1
Molecular Weight1
126.13
CAS
456-49-5
Other Names
  • 3-fluoroanisole
  • 3-fluoromethoxybenzene
  • Benzene, 1-fluoro-3-methoxy-
  • anisole, m-fluoro-
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Physical Properties

Property Value Unit Source
PAff 825.00 kJ/mol NIST
BasG 795.00 kJ/mol NIST
Δf -188.97 kJ/mol Joback Calculated Property
Δfgas -291.08 kJ/mol Joback Calculated Property
Δfus 11.81 kJ/mol Joback Calculated Property
Δvap 48.10 ± 1.10 kJ/mol NIST
IE [8.41; 8.70] eV Show Hide
IE 8.41 ± 0.06 eV NIST
IE 8.70 ± 0.10 eV NIST
log10WS -1.92 Crippen Calculated Property
logPoct/wat 1.834 Crippen Calculated Property
McVol 93.370 ml/mol McGowan Calculated Property
Pc 3736.23 kPa Joback Calculated Property
Inp [908.50; 925.00]   Show Hide
Inp 925.00 NIST
Inp 908.50 NIST
Inp 908.50 NIST
Tboil 412.91 K Joback Calculated Property
Tc 613.45 K Joback Calculated Property
Tfus 230.41 K Joback Calculated Property
Vc 0.355 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [169.33; 222.53] J/mol×K [412.91; 613.45] Show Hide
Cp,gas 169.33 J/mol×K 412.91 Joback Calculated Property
Cp,gas 179.27 J/mol×K 446.33 Joback Calculated Property
Cp,gas 188.77 J/mol×K 479.76 Joback Calculated Property
Cp,gas 197.84 J/mol×K 513.18 Joback Calculated Property
Cp,gas 206.49 J/mol×K 546.61 Joback Calculated Property
Cp,gas 214.72 J/mol×K 580.03 Joback Calculated Property
Cp,gas 222.53 J/mol×K 613.45 Joback Calculated Property
ΔvapH 48.10 kJ/mol 298.15 Experim...

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr [431.00; 431.20] K [99.10; 99.10] Show Hide
Tboilr 431.00 K 99.10 NIST
Tboilr 431.20 K 99.10 NIST

Similar Compounds

Benzene, 1-fluoro-2-methoxy-. Benzene, 1-ethoxy-3-fluoro-. 4-Fluoroveratrole. 2,5-Dimethoxyfluorobenzene. Benzene, 1-fluoro-4-methoxy-. 2,4-Difluoroanisole. 4-Fluoro-2-methoxyphenol. 1-Acetoxy-3-fluorobenzene. Benzene, 1-ethoxy-2-fluoro-. Anisole. 2,3,4-Trifluorophenol, methyl ether. Benzonitrile, 2-fluoro-6-methoxy-. Benzene, 1-ethoxy-4-fluoro-. Phenol, 3-fluoro-. 1,3-dimethoxybenzene.

Find more compounds similar to m-Fluoroanisole.

Sources

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