Chemical Properties of 1,2,2,3-Tetrabromopropane (CAS 54268-02-9)

InChI

InChI=1S/C3H4Br4/c4-1-3(6,7)2-5/h1-2H2

InChI Key

SNLFZAHVOKOBOP-UHFFFAOYSA-N

Formula

C3H4Br4

SMILES

BrCC(Br)(Br)CBr

Molecular Weight¹

359.68

CAS

54268-02-9

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_vap : Vapor pressure (kPa).
• 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

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[176.15; 199.14]	J/mol×K	[529.65; 792.02]
Cp,gas	176.15	J/mol×K	529.65	Joback Calculated Property
Cp,gas	181.47	J/mol×K	573.38	Joback Calculated Property
Cp,gas	186.03	J/mol×K	617.11	Joback Calculated Property
Cp,gas	189.97	J/mol×K	660.83	Joback Calculated Property
Cp,gas	193.39	J/mol×K	704.56	Joback Calculated Property
Cp,gas	196.40	J/mol×K	748.29	Joback Calculated Property
Cp,gas	199.14	J/mol×K	792.02	Joback Calculated Property
η	[0.0003955; 0.0021159]	Pa×s	[365.19; 529.65]
η	0.0021159	Pa×s	365.19	Joback Calculated Property
η	0.0014512	Pa×s	392.60	Joback Calculated Property
η	0.0010455	Pa×s	420.01	Joback Calculated Property
η	0.0007841	Pa×s	447.42	Joback Calculated Property
η	0.0006079	Pa×s	474.83	Joback Calculated Property
η	0.0004846	Pa×s	502.24	Joback Calculated Property
η	0.0003955	Pa×s	529.65	Joback Calculated Property
ΔvapH	57.70	kJ/mol	499.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[398.52; 547.46]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.58334e+01
Coefficient B			-4.84926e+03
Coefficient C			-8.65860e+01
Temperature range, min.			398.52
Temperature range, max.			547.46
Pvap	1.33	kPa	398.52	Calculated Property
Pvap	2.92	kPa	415.07	Calculated Property
Pvap	5.92	kPa	431.62	Calculated Property
Pvap	11.27	kPa	448.17	Calculated Property
Pvap	20.27	kPa	464.72	Calculated Property
Pvap	34.70	kPa	481.26	Calculated Property
Pvap	56.90	kPa	497.81	Calculated Property
Pvap	89.78	kPa	514.36	Calculated Property
Pvap	136.95	kPa	530.91	Calculated Property
Pvap	202.65	kPa	547.46	Calculated Property

Similar Compounds

Find more compounds similar to 1,2,2,3-Tetrabromopropane.

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
• The Yaws Handbook of Vapor Pressure

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