Chemical Properties of 2-Heptadecanone (CAS 2922-51-2)

InChI

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

InChI Key

TVTCXPXLRKTHAU-UHFFFAOYSA-N

Formula

C17H34O

SMILES

CCCCCCCCCCCCCCCC(C)=O

Molecular Weight¹

254.45

CAS

2922-51-2

Other Names

• Heptadecan-2-one

• 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).
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• I : 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°	-36.66	kJ/mol	Joback Calculated Property
ΔfH°gas	-506.79	kJ/mol	Joback Calculated Property
ΔfusH°	41.38	kJ/mol	Joback Calculated Property
ΔvapH°	60.18	kJ/mol	Joback Calculated Property
log10WS	-6.22		Crippen Calculated Property
logPoct/wat	6.057		Crippen Calculated Property
McVol	251.960	ml/mol	McGowan Calculated Property
Pc	1287.44	kPa	Joback Calculated Property
Inp	[317.70; 1910.00]
Inp	1900.00		NIST
Inp	1902.00		NIST
Inp	1889.00		NIST
Inp	1906.00		NIST
Inp	1910.00		NIST
Inp	1883.00		NIST
Inp	1891.10		NIST
Inp	1899.00		NIST
Inp	1871.00		NIST
Inp	Outlier 317.70		NIST
I	[2231.00; 2245.00]
I	2231.00		NIST
I	2245.00		NIST
Tboil	642.23	K	Joback Calculated Property
Tc	809.06	K	Joback Calculated Property
Tfus	331.28	K	Joback Calculated Property
Vc	0.994	m3/kmol	Joback Calculated Property

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; 202.66]	kPa	[451.22; 631.01]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.49646e+01
Coefficient B			-5.07019e+03
Coefficient C			-1.05768e+02
Temperature range, min.			451.22
Temperature range, max.			631.01
Pvap	1.33	kPa	451.22	Calculated Property
Pvap	2.97	kPa	471.20	Calculated Property
Pvap	6.10	kPa	491.17	Calculated Property
Pvap	11.67	kPa	511.15	Calculated Property
Pvap	21.01	kPa	531.13	Calculated Property
Pvap	35.85	kPa	551.10	Calculated Property
Pvap	58.45	kPa	571.08	Calculated Property
Pvap	91.54	kPa	591.06	Calculated Property
Pvap	138.36	kPa	611.03	Calculated Property
Pvap	202.66	kPa	631.01	Calculated Property

Similar Compounds

Find more compounds similar to 2-Heptadecanone.

Sources

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

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.