Chemical Properties of Benzene, (3-chloro-3-methylbutyl)- (CAS 4830-95-9)

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

CAS

4830-95-9

• 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).
• 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
ΔfG°	145.06	kJ/mol	Joback Calculated Property
ΔfH°gas	-58.33	kJ/mol	Joback Calculated Property
ΔfusH°	15.07	kJ/mol	Joback Calculated Property
ΔvapH°	45.45	kJ/mol	Joback Calculated Property
log10WS	-3.80		Crippen 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	511.96	K	Joback Calculated Property
Tc	732.97	K	Joback Calculated Property
Tfus	272.49	K	Joback Calculated Property
Vc	0.582	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[333.04; 415.84]	J/mol×K	[511.96; 732.97]
Cp,gas	333.04	J/mol×K	511.96	Joback Calculated Property
Cp,gas	349.50	J/mol×K	548.80	Joback Calculated Property
Cp,gas	364.81	J/mol×K	585.63	Joback Calculated Property
Cp,gas	379.03	J/mol×K	622.47	Joback Calculated Property
Cp,gas	392.23	J/mol×K	659.30	Joback Calculated Property
Cp,gas	404.48	J/mol×K	696.14	Joback Calculated Property
Cp,gas	415.84	J/mol×K	732.97	Joback Calculated Property
η	[0.0002169; 0.0046976]	Pa×s	[272.49; 511.96]
η	0.0046976	Pa×s	272.49	Joback Calculated Property
η	0.0020281	Pa×s	312.40	Joback Calculated Property
η	0.0010592	Pa×s	352.31	Joback Calculated Property
η	0.0006313	Pa×s	392.23	Joback Calculated Property
η	0.0004140	Pa×s	432.14	Joback Calculated Property
η	0.0002916	Pa×s	472.05	Joback Calculated Property
η	0.0002169	Pa×s	511.96	Joback Calculated Property

Similar Compounds

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

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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