Chemical Properties of bromo(2H3)methane (CAS 1111-88-2)

InChI

InChI=1S/CH3Br/c1-2/h1H3/i1D3

InChI Key

GZUXJHMPEANEGY-FIBGUPNXSA-N

Formula

CD3Br

SMILES

CBr

Molecular Weight¹

97.96

CAS

1111-88-2

Other Names

• Methylbromide-d3

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• IE : Ionization energy (eV).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical 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 Volume, Acentric Factor 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	[40.68; 79.99]	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			1.01700e+01
Coefficient B			1.37020e-01
Coefficient C			-1.02000e-04
Coefficient D			3.48000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	40.68	J/mol×K	273.00	Calculated Property
Cp,gas	47.42	J/mol×K	353.78	Calculated Property
Cp,gas	53.31	J/mol×K	434.56	Calculated Property
Cp,gas	58.46	J/mol×K	515.33	Calculated Property
Cp,gas	62.98	J/mol×K	596.11	Calculated Property
Cp,gas	66.98	J/mol×K	676.89	Calculated Property
Cp,gas	70.57	J/mol×K	757.67	Calculated Property
Cp,gas	73.86	J/mol×K	838.44	Calculated Property
Cp,gas	76.96	J/mol×K	919.22	Calculated Property
Cp,gas	79.99	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0021998; 0.0002423]	Pa×s	[160.83; 331.39]	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			-1.04058e+01
Coefficient B			6.89380e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			160.83
Temperature range, max.			331.39
η	0.0021998	Pa×s	160.83	Calculated Property
η	0.0014001	Pa×s	179.78	Calculated Property
η	0.0009713	Pa×s	198.73	Calculated Property
η	0.0007181	Pa×s	217.68	Calculated Property
η	0.0005572	Pa×s	236.64	Calculated Property
η	0.0004490	Pa×s	255.59	Calculated Property
η	0.0003727	Pa×s	274.54	Calculated Property
η	0.0003169	Pa×s	293.49	Calculated Property
η	0.0002748	Pa×s	312.44	Calculated Property
η	0.0002423	Pa×s	331.39	Calculated Property

Similar Compounds

Find more compounds similar to bromo(2H3)methane.

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.
These property values are available through the Cheméo API. A free account gives you an access key.