Chemical Properties of Benzene, (4-chloropentyl)

InChI

InChI=1S/C11H15Cl/c1-10(12)6-5-9-11-7-3-2-4-8-11/h2-4,7-8,10H,5-6,9H2,1H3

InChI Key

PJONLBBWQJBMHK-UHFFFAOYSA-N

Formula

C11H15Cl

SMILES

CC(Cl)CCCc1ccccc1

Molecular Weight¹

182.69

• 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).
• 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
ω	0.4358		Relay (1.0) Calculated Property
ΔfG°	139.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-74.81	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	18.96	kJ/mol	Joback Calculated Property
ΔvapH°	63.58	kJ/mol	Relay (1.0) Calculated Property
IE	9.14	eV	Relay (1.0) Calculated Property
log10WS	-4.19		Relay (1.0) Calculated Property
logPoct/wat	3.637		Crippen Calculated Property
McVol	154.330	ml/mol	McGowan Calculated Property
Pc	2571.50	kPa	Joback Calculated Property
Inp	[1342.00; 1342.00]
Inp	1342.00		NIST
Inp	1342.00		NIST
Tboil	523.36	K	Relay (1.0) Calculated Property
Tc	729.13	K	Relay (1.0) Calculated Property
Tfus	235.93	K	Relay (1.0) Calculated Property
Vc	0.564	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[194.67; 477.11]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-2.98070e+01
Coefficient B			9.82620e-01
Coefficient C			-6.29400e-04
Coefficient D			1.53700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	194.67	J/mol×K	273.00	Calculated Property
Cp,gas	245.85	J/mol×K	353.78	Calculated Property
Cp,gas	290.95	J/mol×K	434.56	Calculated Property
Cp,gas	330.46	J/mol×K	515.33	Calculated Property
Cp,gas	364.85	J/mol×K	596.11	Calculated Property
Cp,gas	394.61	J/mol×K	676.89	Calculated Property
Cp,gas	420.23	J/mol×K	757.67	Calculated Property
Cp,gas	442.20	J/mol×K	838.44	Calculated Property
Cp,gas	461.00	J/mol×K	919.22	Calculated Property
Cp,gas	477.11	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0049594; 0.0002218]	Pa×s	[255.07; 508.96]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.15352e+01
Coefficient B			1.58876e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			255.07
Temperature range, max.			508.96
η	0.0049594	Pa×s	255.07	Calculated Property
η	0.0026671	Pa×s	283.28	Calculated Property
η	0.0016049	Pa×s	311.49	Calculated Property
η	0.0010508	Pa×s	339.70	Calculated Property
η	0.0007341	Pa×s	367.91	Calculated Property
η	0.0005398	Pa×s	396.12	Calculated Property
η	0.0004134	Pa×s	424.33	Calculated Property
η	0.0003274	Pa×s	452.54	Calculated Property
η	0.0002664	Pa×s	480.75	Calculated Property
η	0.0002218	Pa×s	508.96	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, (4-chloropentyl).

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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