Chemical Properties of 2-Propyl-1-pentanol (CAS 58175-57-8)

InChI

InChI=1S/C8H18O/c1-3-5-8(7-9)6-4-2/h8-9H,3-7H2,1-2H3

InChI Key

LASHFHLFDRTERB-UHFFFAOYSA-N

Formula

C8H18O

SMILES

CCCC(CO)CCC

Molecular Weight¹

130.23

CAS

58175-57-8

Other Names

• 1-Pentanol, 2-propyl-

• 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_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
ω	0.6359		Relay (1.0) Calculated Property
ΔfG°	-122.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-351.19	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	17.04	kJ/mol	Joback Calculated Property
ΔvapH°	65.28	kJ/mol	Relay (1.0) Calculated Property
IE	9.65	eV	Relay (1.0) Calculated Property
log10WS	-2.30		Relay (1.0) Calculated Property
logPoct/wat	2.195		Crippen Calculated Property
McVol	129.450	ml/mol	McGowan Calculated Property
Pc	2811.36	kPa	Joback Calculated Property
Tboil	[452.15; 453.15]	K
Tboil	453.15 ± 3.00	K	NIST
Tboil	452.15 ± 3.00	K	NIST
Tc	638.69	K	Relay (1.0) Calculated Property
Tfus	211.29	K	Relay (1.0) Calculated Property
Vc	0.453	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[290.23; 354.79]	J/mol×K	[474.18; 637.10]
Cp,gas	290.23	J/mol×K	474.18	Joback Calculated Property
Cp,gas	302.08	J/mol×K	501.33	Joback Calculated Property
Cp,gas	313.47	J/mol×K	528.49	Joback Calculated Property
Cp,gas	324.43	J/mol×K	555.64	Joback Calculated Property
Cp,gas	334.96	J/mol×K	582.79	Joback Calculated Property
Cp,gas	345.08	J/mol×K	609.94	Joback Calculated Property
Cp,gas	354.79	J/mol×K	637.10	Joback Calculated Property
η	[0.0001689; 0.1178389]	Pa×s	[225.74; 474.18]
η	0.1178389	Pa×s	225.74	Joback Calculated Property
η	0.0169844	Pa×s	267.15	Joback Calculated Property
η	0.0041171	Pa×s	308.55	Joback Calculated Property
η	0.0013956	Pa×s	349.96	Joback Calculated Property
η	0.0005948	Pa×s	391.37	Joback Calculated Property
η	0.0002984	Pa×s	432.77	Joback Calculated Property
η	0.0001689	Pa×s	474.18	Joback Calculated Property

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[351.85; 477.48]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.53499e+01
Coefficient B			-3.78109e+03
Coefficient C			-1.00818e+02
Temperature range, min.			351.85
Temperature range, max.			477.48
Pvap	1.33	kPa	351.85	Calculated Property
Pvap	2.95	kPa	365.81	Calculated Property
Pvap	6.02	kPa	379.77	Calculated Property
Pvap	11.49	kPa	393.73	Calculated Property
Pvap	20.66	kPa	407.69	Calculated Property
Pvap	35.32	kPa	421.64	Calculated Property
Pvap	57.73	kPa	435.60	Calculated Property
Pvap	90.73	kPa	449.56	Calculated Property
Pvap	137.71	kPa	463.52	Calculated Property
Pvap	202.66	kPa	477.48	Calculated Property

Similar Compounds

Find more compounds similar to 2-Propyl-1-pentanol.

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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