Chemical Properties of 3,6-Dihydroxy-9-methylfluorene

InChI

InChI=1S/C14H12O2/c1-8-11-4-2-9(15)6-13(11)14-7-10(16)3-5-12(8)14/h2-8,15-16H,1H3

InChI Key

XQONGHCSNZQHBO-UHFFFAOYSA-N

Formula

C14H12O2

SMILES

CC1c2ccc(O)cc2-c2cc(O)ccc21

Molecular Weight¹

212.24

• 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).
• 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

Property	Value	Unit	Source
ΔfH°gas	-166.95	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	33.22	kJ/mol	Joback Calculated Property
ΔvapH°	121.28	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	3.230		Crippen Calculated Property
McVol	161.480	ml/mol	McGowan Calculated Property
Inp	[2180.00; 2180.00]
Inp	2180.00		NIST
Inp	2180.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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	[213.18; 519.49]	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			-1.06890e+02
Coefficient B			1.53632e+00
Coefficient C			-1.49184e-03
Coefficient D			5.81900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	213.18	J/mol×K	273.00	Calculated Property
Cp,gas	275.67	J/mol×K	353.78	Calculated Property
Cp,gas	326.76	J/mol×K	434.56	Calculated Property
Cp,gas	368.28	J/mol×K	515.33	Calculated Property
Cp,gas	402.07	J/mol×K	596.11	Calculated Property
Cp,gas	429.97	J/mol×K	676.89	Calculated Property
Cp,gas	453.82	J/mol×K	757.67	Calculated Property
Cp,gas	475.46	J/mol×K	838.44	Calculated Property
Cp,gas	496.74	J/mol×K	919.22	Calculated Property
Cp,gas	519.49	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0000561; 0.0000094]	Pa×s	[573.84; 700.48]	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			-1.96802e+01
Coefficient B			5.67598e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			573.84
Temperature range, max.			700.48
η	0.0000561	Pa×s	573.84	Calculated Property
η	0.0000442	Pa×s	587.91	Calculated Property
η	0.0000353	Pa×s	601.98	Calculated Property
η	0.0000285	Pa×s	616.05	Calculated Property
η	0.0000232	Pa×s	630.13	Calculated Property
η	0.0000190	Pa×s	644.20	Calculated Property
η	0.0000158	Pa×s	658.27	Calculated Property
η	0.0000132	Pa×s	672.34	Calculated Property
η	0.0000111	Pa×s	686.41	Calculated Property
η	0.0000094	Pa×s	700.48	Calculated Property

Similar Compounds

Find more compounds similar to 3,6-Dihydroxy-9-methylfluorene.

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.
These property values are available through the Cheméo API. A free account gives you an access key.