Chemical Properties of 4-Heptadecanone (CAS 53685-77-1)

InChI

InChI=1S/C17H34O/c1-3-5-6-7-8-9-10-11-12-13-14-16-17(18)15-4-2/h3-16H2,1-2H3

InChI Key

UIDOOQRSFZDBLK-UHFFFAOYSA-N

Formula

C17H34O

SMILES

CCCCCCCCCCCCCC(=O)CCC

Molecular Weight¹

254.45

CAS

53685-77-1

Other Names

• heptadecan-4-one

• ω : Acentric Factor.
• 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).
• 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).
• P_vap : Vapor pressure (kPa).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[700.79; 800.76]	J/mol×K	[642.23; 809.06]
Cp,gas	700.79	J/mol×K	642.23	Joback Calculated Property
Cp,gas	719.37	J/mol×K	670.04	Joback Calculated Property
Cp,gas	737.15	J/mol×K	697.84	Joback Calculated Property
Cp,gas	754.16	J/mol×K	725.65	Joback Calculated Property
Cp,gas	770.42	J/mol×K	753.45	Joback Calculated Property
Cp,gas	785.94	J/mol×K	781.26	Joback Calculated Property
Cp,gas	800.76	J/mol×K	809.06	Joback Calculated Property
η	[0.0001395; 0.0032643]	Pa×s	[331.28; 642.23]
η	0.0032643	Pa×s	331.28	Joback Calculated Property
η	0.0013527	Pa×s	383.11	Joback Calculated Property
η	0.0006915	Pa×s	434.93	Joback Calculated Property
η	0.0004078	Pa×s	486.75	Joback Calculated Property
η	0.0002662	Pa×s	538.58	Joback Calculated Property
η	0.0001873	Pa×s	590.40	Joback Calculated Property
η	0.0001395	Pa×s	642.23	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[449.08; 631.77]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.47776e+01
Coefficient B			-4.98789e+03
Coefficient C			-1.04850e+02
Temperature range, min.			449.08
Temperature range, max.			631.77
Pvap	1.33	kPa	449.08	Calculated Property
Pvap	2.99	kPa	469.38	Calculated Property
Pvap	6.15	kPa	489.68	Calculated Property
Pvap	11.77	kPa	509.98	Calculated Property
Pvap	21.18	kPa	530.28	Calculated Property
Pvap	36.13	kPa	550.57	Calculated Property
Pvap	58.82	kPa	570.87	Calculated Property
Pvap	91.95	kPa	591.17	Calculated Property
Pvap	138.68	kPa	611.47	Calculated Property
Pvap	202.65	kPa	631.77	Calculated Property

Similar Compounds

Find more compounds similar to 4-Heptadecanone.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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