Chemical Properties of Dimethyl 2,5-dichloro-4-bromo-3-oxopentanoate

Dimethyl 2,5-dichloro-4-bromo-3-oxopentanoate

InChI
InChI=1S/C6H7BrCl2O3/c1-12-6(11)4(9)5(10)3(7)2-8/h3-4H,2H2,1H3
InChI Key
FMRBNGIONFNJLF-UHFFFAOYSA-N
Formula
C6H7BrCl2O3
SMILES
COC(=O)C(Cl)C(=O)C(Br)CCl
Molecular Weight1
277.93
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Physical Properties

Property Value Unit Source
ΔfusH° 23.90 kJ/mol Joback Calculated Property
ΔvapH° 66.74 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 1.338 Crippen Calculated Property
McVol 146.390 ml/mol McGowan Calculated Property
Inp [1457.00; 1457.00]   Show Hide
Inp 1457.00 NIST
Inp 1457.00 NIST
Tboil 510.49 K Relay (1.0) Calculated Property
Tfus 344.48 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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 [190.19; 352.69] 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 A6.08110e+01
Coefficient B5.54620e-01
Coefficient C-3.07900e-04
Coefficient D4.51600e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 190.19 J/mol×K 273.00 Calculated Property
Cp,gas 220.49 J/mol×K 353.78 Calculated Property
Cp,gas 247.39 J/mol×K 434.56 Calculated Property
Cp,gas 271.04 J/mol×K 515.33 Calculated Property
Cp,gas 291.58 J/mol×K 596.11 Calculated Property
Cp,gas 309.16 J/mol×K 676.89 Calculated Property
Cp,gas 323.92 J/mol×K 757.67 Calculated Property
Cp,gas 336.00 J/mol×K 838.44 Calculated Property
Cp,gas 345.54 J/mol×K 919.22 Calculated Property
Cp,gas 352.69 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0037954; 0.0002785] Pa×s [339.28; 565.67] 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-1.21006e+01
Coefficient B2.21437e+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.339.28
Temperature range, max.565.67
η 0.0037954 Pa×s 339.28 Calculated Property
η 0.0024189 Pa×s 364.43 Calculated Property
η 0.0016339 Pa×s 389.59 Calculated Property
η 0.0011575 Pa×s 414.74 Calculated Property
η 0.0008530 Pa×s 439.90 Calculated Property
η 0.0006497 Pa×s 465.05 Calculated Property
η 0.0005088 Pa×s 490.20 Calculated Property
η 0.0004082 Pa×s 515.36 Calculated Property
η 0.0003342 Pa×s 540.51 Calculated Property
η 0.0002785 Pa×s 565.67 Calculated Property

Similar Compounds

Methyl 4,5-dibromo-2-chloro-3-oxopentanoate. 3'-Hydroxystanozolol, di(trimethylsilyl) ether. «beta»-angelyl-trachelanthamine, TMS. «beta»-tiglyl-trachelanthamine, TMS. 2-([(Dimethylamino)methylene]amino)-3-(3-chloro-4-butyloxy-phenyl)propanoic acid, butyl ester. 3Beta-hydroxy-16,17-secoestra-5(10),6,8-trien-17-oic acid. Florosenine. (-)-3-Menthoxyacetoxy-(+)-estra-1,3,5(10),6,8-pentaen-17-one. Florosenine (otonecine-acetyljacobine). (-)-3-Menthoxyacetoxy-(-)-estra-1,3,5(10),6,8-pentaen-17-one. Butylone M (dihydro), 2Ac. Isoflupredone, bis-MO-tris-TMS. 17 «alpha» Dihydroequilenin. ETHYLBENZOYLECGONINE. Kebuzone, methylated.

Find more compounds similar to Dimethyl 2,5-dichloro-4-bromo-3-oxopentanoate.

Sources

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