Chemical Properties of 2,4,6-Tribromo-3-chloroanisole

2,4,6-Tribromo-3-chloroanisole

InChI
InChI=1S/C7H4Br3ClO/c1-12-7-4(9)2-3(8)6(11)5(7)10/h2H,1H3
InChI Key
FWKUBDOTUFVPBX-UHFFFAOYSA-N
Formula
C7H4Br3ClO
SMILES
COc1c(Br)cc(Br)c(Cl)c1Br
Molecular Weight1
379.27
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Physical Properties

Property Value Unit Source
ΔfusH° 27.61 kJ/mol Joback Calculated Property
log10WS -6.03 Relay (1.0) Calculated Property
logPoct/wat 4.636 Crippen Calculated Property
McVol 156.340 ml/mol McGowan Calculated Property
Inp [1846.00; 1846.00]   Show Hide
Inp 1846.00 NIST
Inp 1846.00 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 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 [177.69; 303.76] 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 A8.27800e+01
Coefficient B4.10120e-01
Coefficient C-2.43640e-04
Coefficient D5.45000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 177.69 J/mol×K 273.00 Calculated Property
Cp,gas 199.79 J/mol×K 353.78 Calculated Property
Cp,gas 219.46 J/mol×K 434.56 Calculated Property
Cp,gas 236.88 J/mol×K 515.33 Calculated Property
Cp,gas 252.22 J/mol×K 596.11 Calculated Property
Cp,gas 265.66 J/mol×K 676.89 Calculated Property
Cp,gas 277.36 J/mol×K 757.67 Calculated Property
Cp,gas 287.49 J/mol×K 838.44 Calculated Property
Cp,gas 296.23 J/mol×K 919.22 Calculated Property
Cp,gas 303.76 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0006380; 0.0002128] Pa×s [476.70; 652.16] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.14387e+01
Coefficient B1.94569e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.476.70
Temperature range, max.652.16
η 0.0006380 Pa×s 476.70 Calculated Property
η 0.0005435 Pa×s 496.20 Calculated Property
η 0.0004686 Pa×s 515.69 Calculated Property
η 0.0004084 Pa×s 535.19 Calculated Property
η 0.0003594 Pa×s 554.68 Calculated Property
η 0.0003191 Pa×s 574.18 Calculated Property
η 0.0002855 Pa×s 593.68 Calculated Property
η 0.0002572 Pa×s 613.17 Calculated Property
η 0.0002333 Pa×s 632.67 Calculated Property
η 0.0002128 Pa×s 652.16 Calculated Property

Similar Compounds

2,6-Dibromo-3-chloroanisole. 2,4-Dibromo-5,6-dichloroanisole. Benzene, 1,3,5-tribromo-2-methoxy-. 2,6-Dibromo-4-chloroanisole. 6-Bromo-2,3-dichloroanisole. 2,6-Dibromo-3,5-dichloroanisole. 6-Bromo-2,3,4-trichloroanisole. Benzene, 2,4-dibromo-1-methoxy-. 2-Bromo-6-chloroanisole. 2-Bromo-4-chloroanisole. 2,4,5-Tribromoanisole. 4-Bromo-2,3,6-trichloroanisole. Benzene, 1,3-dibromo-2-methoxy-. 2-Bromo-4,6-dichloroanisole. 3-Bromo-2,6-dichloroanisole.

Find more compounds similar to 2,4,6-Tribromo-3-chloroanisole.

Sources

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