Chemical Properties of 2-Bromo-5-fluorobenzyl alcohol, 2-methylpropyl ether

2-Bromo-5-fluorobenzyl alcohol, 2-methylpropyl ether

InChI
InChI=1S/C11H14BrFO/c1-8(2)6-14-7-9-5-10(13)3-4-11(9)12/h3-5,8H,6-7H2,1-2H3
InChI Key
ROPJBLWBIZZMJV-UHFFFAOYSA-N
Formula
C11H14BrFO
SMILES
CC(C)COCc1cc(F)ccc1Br
Molecular Weight1
261.13
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 23.54 kJ/mol Joback Calculated Property
logPoct/wat 3.761 Crippen Calculated Property
McVol 167.230 ml/mol McGowan Calculated Property
Inp [1456.00; 1456.00]   Show Hide
Inp 1456.00 NIST
Inp 1456.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [223.95; 497.40] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A2.56820e+01
Coefficient B8.43640e-01
Coefficient C-4.51720e-04
Coefficient D7.98000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 223.95 J/mol×K 273.00 Calculated Property
Cp,gas 271.14 J/mol×K 353.78 Calculated Property
Cp,gas 313.54 J/mol×K 434.56 Calculated Property
Cp,gas 351.40 J/mol×K 515.33 Calculated Property
Cp,gas 384.97 J/mol×K 596.11 Calculated Property
Cp,gas 414.51 J/mol×K 676.89 Calculated Property
Cp,gas 440.27 J/mol×K 757.67 Calculated Property
Cp,gas 462.51 J/mol×K 838.44 Calculated Property
Cp,gas 481.47 J/mol×K 919.22 Calculated Property
Cp,gas 497.40 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-Bromo-5-fluorobenzyl alcohol, n-propyl ether. 2-Bromo-5-fluorobenzyl alcohol, neopentyl ether. 2-Bromo-5-fluorobenzyl alcohol, 2-methylbutyl ether. 2-Bromo-5-fluorobenzyl alcohol, 3-methylbutyl ether. 2-Bromo-5-fluorobenzyl alcohol, n-butyl ether. 2-Bromobenzyl alcohol, 2-methylpropyl ether. Terephthalic acid, 2-bromo-5-fluorobenzyl isobutyl ester. 2-Bromo-5-fluorobenzyl alcohol, n-pentyl ether. 2-Bromo-5-fluorobenzyl alcohol, 1-methylpropyl ether. 2-Bromobenzyl alcohol, 2-methylbutyl ether. (3-Fluorophenyl) methanol, 2-methylpropyl ether. 2-Bromo-5-fluorobenzyl alcohol, isopropyl ether. Glutaric acid, 2-bromo-5-fluorobenzyl isobutyl ester. Phthalic acid, 2-bromo-5-fluorobenzyl isobutyl ester. 2,5-Difluorobenzyl alcohol, 2-methylpropyl ether.

Find more compounds similar to 2-Bromo-5-fluorobenzyl alcohol, 2-methylpropyl ether.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.