Chemical Properties of Ethane, 1-bromo-2,2-dipropoxy- (CAS 61365-93-3)

InChI

InChI=1S/C8H17BrO2/c1-3-5-10-8(7-9)11-6-4-2/h8H,3-7H2,1-2H3

InChI Key

YZXXNXIKOGVZPP-UHFFFAOYSA-N

Formula

C8H17BrO2

SMILES

CCCOC(CBr)OCCC

Molecular Weight¹

225.12

CAS

61365-93-3

Other Names

• 1,1'-[(2-bromoethylidene)bis(oxy)]bispropane

• 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).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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	[219.67; 478.66]	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			5.31250e+01
Coefficient B			6.81540e-01
Coefficient C			-2.64000e-04
Coefficient D			8.00000e-09
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	219.67	J/mol×K	273.00	Calculated Property
Cp,gas	261.55	J/mol×K	353.78	Calculated Property
Cp,gas	300.10	J/mol×K	434.56	Calculated Property
Cp,gas	335.33	J/mol×K	515.33	Calculated Property
Cp,gas	367.28	J/mol×K	596.11	Calculated Property
Cp,gas	395.97	J/mol×K	676.89	Calculated Property
Cp,gas	421.43	J/mol×K	757.67	Calculated Property
Cp,gas	443.68	J/mol×K	838.44	Calculated Property
Cp,gas	462.75	J/mol×K	919.22	Calculated Property
Cp,gas	478.67	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0030762; 0.0002251]	Pa×s	[269.18; 473.65]	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			-1.18413e+01
Coefficient B			1.63050e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			269.18
Temperature range, max.			473.65
η	0.0030762	Pa×s	269.18	Calculated Property
η	0.0019199	Pa×s	291.90	Calculated Property
η	0.0012826	Pa×s	314.62	Calculated Property
η	0.0009047	Pa×s	337.34	Calculated Property
η	0.0006669	Pa×s	360.06	Calculated Property
η	0.0005097	Pa×s	382.77	Calculated Property
η	0.0004015	Pa×s	405.49	Calculated Property
η	0.0003244	Pa×s	428.21	Calculated Property
η	0.0002677	Pa×s	450.93	Calculated Property
η	0.0002251	Pa×s	473.65	Calculated Property

Similar Compounds

Find more compounds similar to Ethane, 1-bromo-2,2-dipropoxy-.

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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