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

• ω : Acentric Factor.
• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5322		Relay (1.0) Calculated Property
ΔfG°	76.89	kJ/mol	Joback Calculated Property
ΔfH°gas	-186.39	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	28.90	kJ/mol	Joback Calculated Property
ΔvapH°	75.40	kJ/mol	Relay (1.0) Calculated Property
IE	9.47	eV	Relay (1.0) Calculated Property
log10WS	-5.92		Relay (1.0) Calculated Property
logPoct/wat	4.204		Crippen Calculated Property
McVol	179.310	ml/mol	McGowan Calculated Property
Pc	3318.18	kPa	Joback Calculated Property
Inp	[1937.00; 1937.00]
Inp	1937.00		NIST
Inp	1937.00		NIST
Tboil	576.07	K	Relay (1.0) Calculated Property
Tc	776.83	K	Relay (1.0) Calculated Property
Tfus	412.14	K	Relay (1.0) Calculated Property
Vc	0.588	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[395.57; 477.24]	J/mol×K	[614.01; 858.93]
Cp,gas	395.57	J/mol×K	614.01	Joback Calculated Property
Cp,gas	411.92	J/mol×K	654.83	Joback Calculated Property
Cp,gas	427.09	J/mol×K	695.65	Joback Calculated Property
Cp,gas	441.14	J/mol×K	736.47	Joback Calculated Property
Cp,gas	454.14	J/mol×K	777.29	Joback Calculated Property
Cp,gas	466.15	J/mol×K	818.11	Joback Calculated Property
Cp,gas	477.24	J/mol×K	858.93	Joback Calculated Property
η	[0.0003398; 0.0019928]	Pa×s	[369.49; 614.01]
η	0.0019928	Pa×s	369.49	Joback Calculated Property
η	0.0012818	Pa×s	410.24	Joback Calculated Property
η	0.0008930	Pa×s	451.00	Joback Calculated Property
η	0.0006605	Pa×s	491.75	Joback Calculated Property
η	0.0005116	Pa×s	532.50	Joback Calculated Property
η	0.0004110	Pa×s	573.26	Joback Calculated Property
η	0.0003398	Pa×s	614.01	Joback Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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