Chemical Properties of 2-Ethyl-1,2-dibromobutane

InChI

InChI=1S/C6H12Br2/c1-3-6(8,4-2)5-7/h3-5H2,1-2H3

InChI Key

UBFOYEMXPUOMHZ-UHFFFAOYSA-N

Formula

C6H12Br2

SMILES

CCC(Br)(CC)CBr

Molecular Weight¹

243.97

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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
ΔfH°gas	-133.13	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	14.45	kJ/mol	Joback Calculated Property
ΔvapH°	49.83	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	3.335		Crippen Calculated Property
McVol	130.400	ml/mol	McGowan Calculated Property
Inp	[1124.00; 1124.00]
Inp	1124.00		NIST
Inp	1124.00		NIST
Tboil	469.47	K	Relay (1.0) Calculated Property
Tfus	225.18	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, 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	[159.28; 348.48]	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			-1.06570e+01
Coefficient B			7.76040e-01
Coefficient C			-6.17200e-04
Coefficient D			2.00300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	159.28	J/mol×K	273.00	Calculated Property
Cp,gas	195.51	J/mol×K	353.78	Calculated Property
Cp,gas	226.46	J/mol×K	434.56	Calculated Property
Cp,gas	252.77	J/mol×K	515.33	Calculated Property
Cp,gas	275.06	J/mol×K	596.11	Calculated Property
Cp,gas	293.97	J/mol×K	676.89	Calculated Property
Cp,gas	310.13	J/mol×K	757.67	Calculated Property
Cp,gas	324.18	J/mol×K	838.44	Calculated Property
Cp,gas	336.76	J/mol×K	919.22	Calculated Property
Cp,gas	348.48	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0041844; 0.0003443]	Pa×s	[279.40; 476.81]	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			-1.15090e+01
Coefficient B			1.68550e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			279.40
Temperature range, max.			476.81
η	0.0041844	Pa×s	279.40	Calculated Property
η	0.0026973	Pa×s	301.33	Calculated Property
η	0.0018455	Pa×s	323.27	Calculated Property
η	0.0013250	Pa×s	345.20	Calculated Property
η	0.0009898	Pa×s	367.14	Calculated Property
η	0.0007641	Pa×s	389.07	Calculated Property
η	0.0006064	Pa×s	411.00	Calculated Property
η	0.0004926	Pa×s	432.94	Calculated Property
η	0.0004083	Pa×s	454.87	Calculated Property
η	0.0003443	Pa×s	476.81	Calculated Property

Similar Compounds

Find more compounds similar to 2-Ethyl-1,2-dibromobutane.

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

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.
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