Chemical Properties of 1,3,5-tris-(Bromomethyl) cyclohexane

InChI

InChI=1S/C9H15Br3/c10-4-7-1-8(5-11)3-9(2-7)6-12/h7-9H,1-6H2

InChI Key

HPDNDWLWKJEJTR-UHFFFAOYSA-N

Formula

C9H15Br3

SMILES

BrCC1CC(CBr)CC(CBr)C1

Molecular Weight¹

362.93

• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	28.90	kJ/mol	Joback Calculated Property
logPoct/wat	4.204		Crippen Calculated Property
McVol	179.310	ml/mol	McGowan Calculated Property
Inp	[1937.00; 1937.00]
Inp	1937.00		NIST
Inp	1937.00		NIST
Tboil	576.07	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[395.66; 477.31]	J/mol×K	[614.21; 859.21]
Cp,gas	395.66	J/mol×K	614.21	Joback Calculated Property
Cp,gas	412.00	J/mol×K	655.04	Joback Calculated Property
Cp,gas	427.17	J/mol×K	695.88	Joback Calculated Property
Cp,gas	441.22	J/mol×K	736.71	Joback Calculated Property
Cp,gas	454.22	J/mol×K	777.54	Joback Calculated Property
Cp,gas	466.23	J/mol×K	818.38	Joback Calculated Property
Cp,gas	477.31	J/mol×K	859.21	Joback Calculated Property
η	[0.0003396; 0.0019928]	Pa×s	[369.49; 614.21]
η	0.0019928	Pa×s	369.49	Joback Calculated Property
η	0.0012814	Pa×s	410.28	Joback Calculated Property
η	0.0008925	Pa×s	451.06	Joback Calculated Property
η	0.0006601	Pa×s	491.85	Joback Calculated Property
η	0.0005112	Pa×s	532.64	Joback Calculated Property
η	0.0004106	Pa×s	573.42	Joback Calculated Property
η	0.0003396	Pa×s	614.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,3,5-tris-(Bromomethyl) cyclohexane.

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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