Chemical Properties of Fluorene, 1,2,3,4,4a,9a-hexahydro-, cis- (CAS 1559-97-3)

InChI

InChI=1S/C13H16/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1,3,5,7,11,13H,2,4,6,8-9H2/t11-,13+/m0/s1

InChI Key

OSJFWOVKJZKBOA-WCQYABFASA-N

Formula

C13H16

SMILES

c1ccc2c(c1)CC1CCCCC21

Molecular Weight¹

172.27

CAS

1559-97-3

• 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).
• 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, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[174.78; 529.70]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.34140e+02
Coefficient B			1.39260e+00
Coefficient C			-1.04156e-03
Coefficient D			3.12800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	174.78	J/mol×K	273.00	Calculated Property
Cp,gas	242.02	J/mol×K	353.78	Calculated Property
Cp,gas	300.00	J/mol×K	434.56	Calculated Property
Cp,gas	349.72	J/mol×K	515.33	Calculated Property
Cp,gas	392.15	J/mol×K	596.11	Calculated Property
Cp,gas	428.29	J/mol×K	676.89	Calculated Property
Cp,gas	459.12	J/mol×K	757.67	Calculated Property
Cp,gas	485.64	J/mol×K	838.44	Calculated Property
Cp,gas	508.84	J/mol×K	919.22	Calculated Property
Cp,gas	529.70	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0019221; 0.0007080]	Pa×s	[307.57; 549.11]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-8.52493e+00
Coefficient B			6.98370e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			307.57
Temperature range, max.			549.11
η	0.0019221	Pa×s	307.57	Calculated Property
η	0.0016019	Pa×s	334.41	Calculated Property
η	0.0013717	Pa×s	361.25	Calculated Property
η	0.0012000	Pa×s	388.08	Calculated Property
η	0.0010682	Pa×s	414.92	Calculated Property
η	0.0009644	Pa×s	441.76	Calculated Property
η	0.0008809	Pa×s	468.60	Calculated Property
η	0.0008126	Pa×s	495.44	Calculated Property
η	0.0007558	Pa×s	522.27	Calculated Property
η	0.0007080	Pa×s	549.11	Calculated Property

Similar Compounds

Find more compounds similar to Fluorene, 1,2,3,4,4a,9a-hexahydro-, cis-.

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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