Chemical Properties of Acetic acid, dibromo, 1,1-dimethylethyl ester

InChI

InChI=1S/C6H10Br2O2/c1-6(2,3)10-5(9)4(7)8/h4H,1-3H3

InChI Key

WVNZGIJOOOHIPU-UHFFFAOYSA-N

Formula

C6H10Br2O2

SMILES

CC(C)(C)OC(=O)C(Br)Br

Molecular Weight¹

273.95

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-443.61	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	15.30	kJ/mol	Joback Calculated Property
ΔvapH°	58.56	kJ/mol	Relay (1.0) Calculated Property
log10WS	-2.47		Relay (1.0) Calculated Property
logPoct/wat	2.444		Crippen Calculated Property
McVol	137.840	ml/mol	McGowan Calculated Property
Pc	3791.65	kPa	Joback Calculated Property
Inp	[1103.00; 1103.00]
Inp	1103.00		NIST
Inp	1103.00		NIST
I	1564.00		NIST
Tboil	472.67	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Volume, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[270.19; 322.64]	J/mol×K	[523.75; 748.68]
Cp,gas	270.19	J/mol×K	523.75	Joback Calculated Property
Cp,gas	280.79	J/mol×K	561.24	Joback Calculated Property
Cp,gas	290.58	J/mol×K	598.73	Joback Calculated Property
Cp,gas	299.62	J/mol×K	636.21	Joback Calculated Property
Cp,gas	307.95	J/mol×K	673.70	Joback Calculated Property
Cp,gas	315.60	J/mol×K	711.19	Joback Calculated Property
Cp,gas	322.64	J/mol×K	748.68	Joback Calculated Property
η	[0.0002588; 0.0044935]	Pa×s	[306.73; 523.75]
η	0.0044935	Pa×s	306.73	Joback Calculated Property
η	0.0021727	Pa×s	342.90	Joback Calculated Property
η	0.0012068	Pa×s	379.07	Joback Calculated Property
η	0.0007426	Pa×s	415.24	Joback Calculated Property
η	0.0004940	Pa×s	451.41	Joback Calculated Property
η	0.0003490	Pa×s	487.58	Joback Calculated Property
η	0.0002588	Pa×s	523.75	Joback Calculated Property

Similar Compounds

Find more compounds similar to Acetic acid, dibromo, 1,1-dimethylethyl ester.

Sources

• Cheméo Relay (1.0)
• 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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