Chemical Properties of Cyclopentane, 1,1,3,4-tetramethyl-, trans-

InChI

InChI=1S/C9H18/c1-7-5-9(3,4)6-8(7)2/h7-8H,5-6H2,1-4H3/t7-,8-/m0/s1

InChI Key

OWHFMVURUNNXMJ-HTQZYQBOSA-N

Formula

C9H18

SMILES

C[C@H]1CC(C)(C)C[C@@H]1C

Molecular Weight¹

126.24

Other Names

• trans-1,1,3,4-Tetramethylcyclopentane

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfusH°	8.84	kJ/mol	Joback Calculated Property
ΔvapH°	38.61	kJ/mol	Relay (1.0) Calculated Property
IE	9.34	eV	Relay (1.0) Calculated Property
log10WS	-4.73		Relay (1.0) Calculated Property
logPoct/wat	3.079		Crippen Calculated Property
McVol	126.810	ml/mol	McGowan Calculated Property
Inp	[772.00; 779.00]
Inp	772.00		NIST
Inp	775.00		NIST
Inp	776.00		NIST
Inp	778.00		NIST
Inp	779.00		NIST
Inp	772.00		NIST
Inp	778.00		NIST
Tboil	[394.76; 394.80]	K
Tboil	394.76 ± 0.10	K	NIST
Tboil	394.80 ± 0.30	K	NIST
Tfus	[179.21; 180.46]	K
Tfus	180.06 ± 0.03	K	NIST
Tfus	180.06 ± 0.04	K	NIST
Tfus	180.46 ± 0.06	K	NIST
Tfus	179.21 ± 0.30	K	NIST

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[256.44; 354.09]	J/mol×K	[411.50; 610.26]
Cp,gas	256.44	J/mol×K	411.50	Joback Calculated Property
Cp,gas	275.25	J/mol×K	444.63	Joback Calculated Property
Cp,gas	292.94	J/mol×K	477.75	Joback Calculated Property
Cp,gas	309.58	J/mol×K	510.88	Joback Calculated Property
Cp,gas	325.27	J/mol×K	544.01	Joback Calculated Property
Cp,gas	340.08	J/mol×K	577.14	Joback Calculated Property
Cp,gas	354.09	J/mol×K	610.26	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclopentane, 1,1,3,4-tetramethyl-, trans-.

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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