Chemical Properties of Methoxychlor (CAS 72-43-5)

Methoxychlor

InChI
InChI=1S/C16H15Cl3O2/c1-20-13-7-3-11(4-8-13)15(16(17,18)19)12-5-9-14(21-2)10-6-12/h3-10,15H,1-2H3
InChI Key
IAKOZHOLGAGEJT-UHFFFAOYSA-N
Formula
C16H15Cl3O2
SMILES
COc1ccc(C(c2ccc(OC)cc2)C(Cl)(Cl)Cl)cc1
Molecular Weight1
345.65
CAS
72-43-5
Other Names
  • 1,1'-(2,2,2-Trichloroethylidene)bis(4-methoxybenzene)
  • 1,1,1-Trichlor-2,2-bis(4-methoxy-phenyl)-aethan
  • 1,1,1-Trichloro-2,2-bis(4-methoxyphenyl)ethane
  • 1,1,1-Trichloro-2,2-bis(p-anisyl)ethane
  • 1,1,1-Trichloro-2,2-bis(p-methoxyphenyl)ethane
  • 1,1,1-Trichloro-2,2-di(4-methoxyphenyl)ethane
  • 1,1-Bis(p-methoxyphenyl)-2,2,2-trichloroethane
  • 1-methoxy-4-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]benzene
  • 2,2,2-Trichloro-1,1-bis(4-methoxyphenyl)ethane
  • 2,2-Bis (p-methoxyphenol)-1,1,1-trichloroethane
  • 2,2-Bis(p-anisyl)-1,1,1-trichloroethane
  • 2,2-Bis(p-methoxyphenyl)-1,1,1-trichloroethane
  • 2,2-Di(p-anisyl)-1,1,1-trichloroethane
  • 2,2-Di(p-methoxyphenyl)-1,1,1-trichloroethane
  • 4,4-(2,2,2-Trichloroethylidene)dianisole
  • Benzene, 1,1'-(2,2,2-trichloroethylidene)bis*4-methoxy-
  • Benzene, 1,1'-(2,2,2-trichloroethylidene)bis[4-methoxy-
  • Chemform
  • DMDT
  • Di(p-methoxyphenyl)trichloromethyl methane
  • Dianisyltrichlorethane
  • Dimethoxy-DDT
  • Dimethoxy-dt
  • Double-M ec
  • ENT 1,716
  • Ethane, 1,1,1-trichloro-2,2-bis(p-methoxyphenyl)-
  • Ethane, 2,2-bis(p-anisyl)-1,1,1-trichloro-
  • Flo pro mcseed protectant
  • Higalmetox
  • Maralate
  • Marlate
  • MeOCl
  • Mesox K
  • Methoxcide
  • Methoxy-DDT
  • Methoxychlor 2 EC
  • Methoxychlore
  • Metoksychlor
  • Metox
  • Mezox K
  • Moxie
  • NCI-C00497
  • OMS 466
  • RCRA Waste number U247
  • p,p'-(Dimethoxydiphenyl)trichloroethane
  • p,p'-DMDT
  • p,p'-Dwumetoksydwufenylotrojchloroetan
  • p,p'-Methoxychlor
  • pMethoxychlor
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Physical Properties

Property Value Unit Source
ΔfusH° 28.53 kJ/mol Joback Calculated Property
ΔvapH° 87.60 kJ/mol Relay (1.0) Calculated Property
IE 8.06 eV Relay (1.0) Calculated Property
log10WS [-6.89; -6.59]   Show Hide
log10WS -6.59 Aq. Solubility Prediction
log10WS -6.89 Estimated Solubility
logPoct/wat 5.206 Crippen Calculated Property
McVol 237.240 ml/mol McGowan Calculated Property
Inp [2395.00; 2491.00]   Show Hide
Inp 2413.00 NIST
Inp 2401.00 NIST
Inp 2418.00 NIST
Inp 2410.00 NIST
Inp 2439.30 NIST
Inp 2420.00 NIST
Inp 2420.00 NIST
Inp Outlier 2491.00 NIST
Inp 2395.00 NIST
Inp 2417.00 NIST
Inp 2420.00 NIST
Inp 2417.00 NIST
Inp 2439.30 NIST
Inp 2420.00 NIST
Tboil 654.54 K Relay (1.0) Calculated Property
Tc 901.78 K Relay (1.0) Calculated Property
Tfus [361.56; 362.70] K Show Hide
Tfus 361.56 ± 0.20 K NIST
Tfus 362.70 ± 0.20 K NIST

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔfusH 27.48 kJ/mol 360.60 NIST

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [304.74; 665.47] 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 A1.26500e+01
Coefficient B1.27274e+00
Coefficient C-7.89120e-04
Coefficient D1.69200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 304.74 J/mol×K 273.00 Calculated Property
Cp,gas 371.64 J/mol×K 353.78 Calculated Property
Cp,gas 430.59 J/mol×K 434.56 Calculated Property
Cp,gas 482.13 J/mol×K 515.33 Calculated Property
Cp,gas 526.77 J/mol×K 596.11 Calculated Property
Cp,gas 565.07 J/mol×K 676.89 Calculated Property
Cp,gas 597.55 J/mol×K 757.67 Calculated Property
Cp,gas 624.76 J/mol×K 838.44 Calculated Property
Cp,gas 647.22 J/mol×K 919.22 Calculated Property
Cp,gas 665.47 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0033415; 0.0000688] Pa×s [362.13; 722.96] 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-1.34826e+01
Coefficient B2.81782e+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.362.13
Temperature range, max.722.96
η 0.0033415 Pa×s 362.13 Calculated Property
η 0.0015385 Pa×s 402.22 Calculated Property
η 0.0008153 Pa×s 442.31 Calculated Property
η 0.0004802 Pa×s 482.41 Calculated Property
η 0.0003067 Pa×s 522.50 Calculated Property
η 0.0002088 Pa×s 562.59 Calculated Property
η 0.0001497 Pa×s 602.68 Calculated Property
η 0.0001118 Pa×s 642.77 Calculated Property
η 0.0000864 Pa×s 682.87 Calculated Property
η 0.0000688 Pa×s 722.96 Calculated Property

Similar Compounds

Benzene, 1-methoxy-2-[2,2,2-trichloro-1-(4-methoxyphenyl)ethyl]-. DPE. Benzene, 1,1'-(2,2,2-trichloroethylidene)bis(4-methyl-. 1,1-Bis-(4-bromophenyl)-2,2,2-trichloroethane. p,p'-DDT. Ethane, 2-(p-bromophenyl)-1,1,1-trichloro-2-phenyl-. BENZENE, 1,1'-(2,2-DICHLOROETHYLIDENE)BIS-. Diphenylacetyl chloride. 4,4'-ETHYLIDENEDIPHENOL. 4-(1-Phenylethyl)phenol. 1,1-Dichloro-2,2-bis(p-chlorophenyl)ethane. m,p'-DDT. Benzene, 1,1'-(2,2-dichloroethylidene)bis[4-ethyl-. (S)-1,1-bis(4-Methoxyphenyl)propan-2-ol. Tris[4-(1-phenylethyl)phenyl] phosphate.

Find more compounds similar to Methoxychlor.

Sources

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