Chemical Properties of 1,2,3,4-Tetrahydrochrysene (CAS 2091-90-9)

InChI

InChI=1S/C18H16/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1,3,5,7,9-12H,2,4,6,8H2

InChI Key

YMLBMIKSAYQNNI-UHFFFAOYSA-N

Formula

C18H16

SMILES

c1ccc2c(c1)ccc1c3c(ccc12)CCCC3

Molecular Weight¹

232.32

CAS

2091-90-9

Other Names

• Chrysene, 1,2,3,4-tetrahydro-
• 1,2,3,4-tetrahydrocrysene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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

Cheméo can also estimate 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	[516.58; 603.79]	J/mol×K	[706.70; 965.35]
Cp,gas	516.58	J/mol×K	706.70	Joback Calculated Property
Cp,gas	533.78	J/mol×K	749.81	Joback Calculated Property
Cp,gas	549.64	J/mol×K	792.92	Joback Calculated Property
Cp,gas	564.38	J/mol×K	836.02	Joback Calculated Property
Cp,gas	578.18	J/mol×K	879.13	Joback Calculated Property
Cp,gas	591.25	J/mol×K	922.24	Joback Calculated Property
Cp,gas	603.79	J/mol×K	965.35	Joback Calculated Property
η	[0.0006476; 0.0018601]	Pa×s	[440.66; 706.70]
η	0.0018601	Pa×s	440.66	Joback Calculated Property
η	0.0014397	Pa×s	485.00	Joback Calculated Property
η	0.0011631	Pa×s	529.34	Joback Calculated Property
η	0.0009712	Pa×s	573.68	Joback Calculated Property
η	0.0008322	Pa×s	618.02	Joback Calculated Property
η	0.0007280	Pa×s	662.36	Joback Calculated Property
η	0.0006476	Pa×s	706.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2,3,4-Tetrahydrochrysene.

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.