Chemical Properties of Phenol, 3-pentadecyl- (CAS 501-24-6)

InChI

InChI=1S/C21H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-20-17-15-18-21(22)19-20/h15,17-19,22H,2-14,16H2,1H3

InChI Key

PTFIPECGHSYQNR-UHFFFAOYSA-N

Formula

C21H36O

SMILES

CCCCCCCCCCCCCCCc1cccc(O)c1

Molecular Weight¹

304.51

CAS

501-24-6

Other Names

• 3-n-Pentadecylphenol
• 3-pentadecylphenol
• Anacardol, tetrahydro-
• Cardolite NC-507
• Cardolite NC-510
• Cyclogallipharaol
• Hydroginkgol
• NSC 9781
• hydrocardanol
• m-pentadecylphenol
• phenol, m-pentadecyl-
• tetrahydroanacardol

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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_boilr : Boiling point at reduced pressure (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

Property	Value	Unit	Source
ΔfG°	83.73	kJ/mol	Joback Calculated Property
ΔfH°gas	-417.55	kJ/mol	Joback Calculated Property
ΔfusH°	38.09	kJ/mol	Solubil...
ΔvapH°	77.63	kJ/mol	Joback Calculated Property
log10WS	-7.26		Crippen Calculated Property
logPoct/wat	7.026		Crippen Calculated Property
McVol	288.860	ml/mol	McGowan Calculated Property
Pc	1318.48	kPa	Joback Calculated Property
Inp	[2499.80; 2499.80]
Inp	2499.80		NIST
Inp	2499.80		NIST
Tboil	787.18	K	Joback Calculated Property
Tc	980.56	K	Joback Calculated Property
Tfus	325.20 ± 1.50	K	NIST
Vc	1.069	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[896.46; 997.72]	J/mol×K	[787.18; 980.56]
Cp,gas	896.46	J/mol×K	787.18	Joback Calculated Property
Cp,gas	915.30	J/mol×K	819.41	Joback Calculated Property
Cp,gas	933.25	J/mol×K	851.64	Joback Calculated Property
Cp,gas	950.39	J/mol×K	883.87	Joback Calculated Property
Cp,gas	966.79	J/mol×K	916.10	Joback Calculated Property
Cp,gas	982.54	J/mol×K	948.33	Joback Calculated Property
Cp,gas	997.72	J/mol×K	980.56	Joback Calculated Property
η	[0.0000053; 0.0003779]	Pa×s	[464.57; 787.18]
η	0.0003779	Pa×s	464.57	Joback Calculated Property
η	0.0001284	Pa×s	518.34	Joback Calculated Property
η	0.0000534	Pa×s	572.11	Joback Calculated Property
η	0.0000259	Pa×s	625.88	Joback Calculated Property
η	0.0000140	Pa×s	679.64	Joback Calculated Property
η	0.0000083	Pa×s	733.41	Joback Calculated Property
η	0.0000053	Pa×s	787.18	Joback Calculated Property
ΔfusH	38.09	kJ/mol	322.40	NIST

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[465.70; 470.20]	K	[0.10; 0.10]
Tboilr	465.70	K	0.10	NIST
Tboilr	470.20	K	0.10	NIST

Similar Compounds

Find more compounds similar to Phenol, 3-pentadecyl-.

Mixtures

• Phenol, 3-pentadecyl- + Ethanol
• Phenol, 3-pentadecyl- + 1-Butanol
• Phenol, 3-pentadecyl- + Toluene
• Phenol, 3-pentadecyl- + Acetone
• Phenol, 3-pentadecyl- + Carbon Tetrachloride
• Phenol, 3-pentadecyl- + Ethyl Acetate

Sources

• Crippen Method
• Crippen Method
• Solubilities of 3-Pentadecylphenol in Ethanol, 1-Butanol, Toluene, Acetone, Tetrachloromethane, and Ethyl Acetate
• Joback Method
• McGowan Method
• NIST Webbook

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