Chemical Properties of 3-Methyl-2,3-dibromopentane

InChI

InChI=1S/C6H12Br2/c1-4-6(3,8)5(2)7/h5H,4H2,1-3H3

InChI Key

VYEPHBKIORGLPY-UHFFFAOYSA-N

Formula

C6H12Br2

SMILES

CCC(C)(Br)C(C)Br

Molecular Weight¹

243.97

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	10.93	kJ/mol	Joback Calculated Property
logPoct/wat	3.333		Crippen Calculated Property
McVol	130.400	ml/mol	McGowan Calculated Property
Inp	[1084.00; 1106.00]
Inp	1106.00		NIST
Inp	1084.00		NIST
Inp	1106.00		NIST
Tboil	463.05	K	Relay (1.0) Calculated Property
Tfus	245.34	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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	[158.96; 349.02]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.23390e+01
Coefficient B			7.81960e-01
Coefficient C			-6.20400e-04
Coefficient D			1.99800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	158.96	J/mol×K	273.00	Calculated Property
Cp,gas	195.50	J/mol×K	353.78	Calculated Property
Cp,gas	226.71	J/mol×K	434.56	Calculated Property
Cp,gas	253.22	J/mol×K	515.33	Calculated Property
Cp,gas	275.66	J/mol×K	596.11	Calculated Property
Cp,gas	294.67	J/mol×K	676.89	Calculated Property
Cp,gas	310.88	J/mol×K	757.67	Calculated Property
Cp,gas	324.92	J/mol×K	838.44	Calculated Property
Cp,gas	337.42	J/mol×K	919.22	Calculated Property
Cp,gas	349.02	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0059456; 0.0003179]	Pa×s	[264.40; 480.13]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.16430e+01
Coefficient B			1.72332e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			264.40
Temperature range, max.			480.13
η	0.0059456	Pa×s	264.40	Calculated Property
η	0.0034587	Pa×s	288.37	Calculated Property
η	0.0021864	Pa×s	312.34	Calculated Property
η	0.0014755	Pa×s	336.31	Calculated Property
η	0.0010493	Pa×s	360.28	Calculated Property
η	0.0007786	Pa×s	384.25	Calculated Property
η	0.0005983	Pa×s	408.22	Calculated Property
η	0.0004734	Pa×s	432.19	Calculated Property
η	0.0003839	Pa×s	456.16	Calculated Property
η	0.0003179	Pa×s	480.13	Calculated Property

Similar Compounds

Find more compounds similar to 3-Methyl-2,3-dibromopentane.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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