Chemical Properties of Nonylphenol (CAS 25154-52-3)

InChI

InChI=1S/C15H24O/c1-11(2)9-12(3)10-13(4)14-5-7-15(16)8-6-14/h5-8,11-13,16H,9-10H2,1-4H3

InChI Key

SLULBVLEUPOSOI-UHFFFAOYSA-N

Formula

C15H24O

SMILES

CC(C)CC(C)CC(C)c1ccc(O)cc1

Molecular Weight¹

220.35

CAS

25154-52-3

Other Names

• Phenol, nonyl-

• 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_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).
• NFPA Fire : NFPA Fire Rating.
• NFPA Health : NFPA Health Rating.
• P_c : Critical Pressure (kPa).
• P_vap : Vapor 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

Property	Value	Unit	Source
ΔfG°	25.89	kJ/mol	Joback Calculated Property
ΔfH°gas	-309.55	kJ/mol	Joback Calculated Property
ΔfusH°	23.86	kJ/mol	Joback Calculated Property
ΔvapH°	63.11	kJ/mol	Joback Calculated Property
log10WS	-4.23		Crippen Calculated Property
logPoct/wat	4.568		Crippen Calculated Property
McVol	204.320	ml/mol	McGowan Calculated Property
NFPA Fire	1		KDB
NFPA Health	2		KDB
Pc	2155.30	kPa	Joback Calculated Property
Inp	[1720.00; 1733.00]
Inp	1720.00		NIST
Inp	1733.00		NIST
Tboil	648.58	K	Joback Calculated Property
Tc	861.97	K	Joback Calculated Property
Tfus	351.95	K	Joback Calculated Property
Vc	0.716	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[558.96; 651.91]	J/mol×K	[648.58; 861.97]
Cp,gas	558.96	J/mol×K	648.58	Joback Calculated Property
Cp,gas	576.84	J/mol×K	684.14	Joback Calculated Property
Cp,gas	593.65	J/mol×K	719.71	Joback Calculated Property
Cp,gas	609.47	J/mol×K	755.27	Joback Calculated Property
Cp,gas	624.40	J/mol×K	790.84	Joback Calculated Property
Cp,gas	638.52	J/mol×K	826.40	Joback Calculated Property
Cp,gas	651.91	J/mol×K	861.97	Joback Calculated Property
η	[0.0000157; 0.0046742]	Pa×s	[351.95; 648.58]
η	0.0046742	Pa×s	351.95	Joback Calculated Property
η	0.0010084	Pa×s	401.39	Joback Calculated Property
η	0.0003045	Pa×s	450.83	Joback Calculated Property
η	0.0001165	Pa×s	500.26	Joback Calculated Property
η	0.0000530	Pa×s	549.70	Joback Calculated Property
η	0.0000275	Pa×s	599.14	Joback Calculated Property
η	0.0000157	Pa×s	648.58	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[452.61; 589.58]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.80470e+01
Coefficient B			-6.16655e+03
Coefficient C			-1.05381e+02
Temperature range, min.			452.61
Temperature range, max.			589.58
Pvap	1.33	kPa	452.61	Calculated Property
Pvap	2.81	kPa	467.83	Calculated Property
Pvap	5.58	kPa	483.05	Calculated Property
Pvap	10.50	kPa	498.27	Calculated Property
Pvap	18.86	kPa	513.49	Calculated Property
Pvap	32.46	kPa	528.70	Calculated Property
Pvap	53.82	kPa	543.92	Calculated Property
Pvap	86.24	kPa	559.14	Calculated Property
Pvap	134.05	kPa	574.36	Calculated Property
Pvap	202.65	kPa	589.58	Calculated Property
Pvap	[9.59e-07; 2017.39]	kPa	[279.15; 757.00]	KDB Vap...
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			1.35332e+02
Coefficient B			-1.58023e+04
Coefficient C			-1.65004e+01
Coefficient D			4.43190e-06
Temperature range, min.			279.15
Temperature range, max.			757.00
Pvap	9.59e-07	kPa	279.15	Calculated Property
Pvap	5.31e-04	kPa	332.24	Calculated Property
Pvap	0.04	kPa	385.34	Calculated Property
Pvap	0.79	kPa	438.43	Calculated Property
Pvap	7.33	kPa	491.53	Calculated Property
Pvap	39.54	kPa	544.62	Calculated Property
Pvap	146.72	kPa	597.72	Calculated Property
Pvap	417.76	kPa	650.81	Calculated Property
Pvap	983.51	kPa	703.91	Calculated Property
Pvap	2017.39	kPa	757.00	Calculated Property

Similar Compounds

Find more compounds similar to Nonylphenol.

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Crippen Method
• Joback Method
• KDB
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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