Chemical Properties of Benzene, (3-chloro-3-methylbutyl)-

InChI

InChI=1S/C11H15Cl/c1-11(2,12)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3

InChI Key

GCAZETCXAVCJCN-UHFFFAOYSA-N

Formula

C11H15Cl

SMILES

CC(C)(Cl)CCc1ccccc1

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	0.3816		Relay (1.0) Calculated Property
ΔfG°	145.06	kJ/mol	Joback Calculated Property
ΔfH°gas	-61.91	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	15.07	kJ/mol	Joback Calculated Property
ΔvapH°	60.11	kJ/mol	Relay (1.0) Calculated Property
IE	9.12	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	2600.43	kPa	Joback Calculated Property
Inp	[1326.00; 1326.00]
Inp	1326.00		NIST
Inp	1326.00		NIST
Tboil	504.06	K	Relay (1.0) Calculated Property
Tc	726.34	K	Relay (1.0) Calculated Property
Tfus	259.62	K	Relay (1.0) Calculated Property
Vc	0.558	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[333.13; 415.93]	J/mol×K	[512.16; 733.26]
Cp,gas	333.13	J/mol×K	512.16	Joback Calculated Property
Cp,gas	349.60	J/mol×K	549.01	Joback Calculated Property
Cp,gas	364.90	J/mol×K	585.86	Joback Calculated Property
Cp,gas	379.12	J/mol×K	622.71	Joback Calculated Property
Cp,gas	392.32	J/mol×K	659.56	Joback Calculated Property
Cp,gas	404.57	J/mol×K	696.41	Joback Calculated Property
Cp,gas	415.93	J/mol×K	733.26	Joback Calculated Property
η	[0.0002166; 0.0046976]	Pa×s	[272.49; 512.16]
η	0.0046976	Pa×s	272.49	Joback Calculated Property
η	0.0020269	Pa×s	312.44	Joback Calculated Property
η	0.0010581	Pa×s	352.38	Joback Calculated Property
η	0.0006306	Pa×s	392.32	Joback Calculated Property
η	0.0004135	Pa×s	432.27	Joback Calculated Property
η	0.0002912	Pa×s	472.21	Joback Calculated Property
η	0.0002166	Pa×s	512.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, (3-chloro-3-methylbutyl)-.

Sources

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

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