Chemical Properties of trans-Indan-1,2-diol

InChI

InChI=1S/C9H12O2/c10-8-5-6-3-1-2-4-7(6)9(8)11/h1-4,6-11H,5H2/t6?,7?,8-,9-/m0/s1

InChI Key

WHWGIACBFRFQHW-PEBLOWIWSA-N

Formula

C9H12O2

SMILES

OC1CC2C=CC=CC2C1O

Molecular Weight¹

152.19

• 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).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, 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, 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	[328.93; 392.02]	J/mol×K	[605.15; 798.45]
Cp,gas	328.93	J/mol×K	605.15	Joback Calculated Property
Cp,gas	341.16	J/mol×K	637.37	Joback Calculated Property
Cp,gas	352.67	J/mol×K	669.58	Joback Calculated Property
Cp,gas	363.47	J/mol×K	701.80	Joback Calculated Property
Cp,gas	373.60	J/mol×K	734.02	Joback Calculated Property
Cp,gas	383.11	J/mol×K	766.24	Joback Calculated Property
Cp,gas	392.02	J/mol×K	798.45	Joback Calculated Property
η	[0.0001141; 0.0139990]	Pa×s	[331.19; 605.15]
η	0.0139990	Pa×s	331.19	Joback Calculated Property
η	0.0038642	Pa×s	376.85	Joback Calculated Property
η	0.0014088	Pa×s	422.51	Joback Calculated Property
η	0.0006253	Pa×s	468.17	Joback Calculated Property
η	0.0003207	Pa×s	513.83	Joback Calculated Property
η	0.0001834	Pa×s	559.49	Joback Calculated Property
η	0.0001141	Pa×s	605.15	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-Indan-1,2-diol.

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

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