Chemical Properties of Benzene, (1,1-diethylpropyl)- (CAS 4170-84-7)

InChI

InChI=1S/C13H20/c1-4-13(5-2,6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3

InChI Key

WLVNEALRNQEPMS-UHFFFAOYSA-N

Formula

C13H20

SMILES

CCC(CC)(CC)c1ccccc1

Molecular Weight¹

176.30

CAS

4170-84-7

Other Names

• (1,1-Diethylpropyl)benzene

• 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°	173.83	kJ/mol	Joback Calculated Property
ΔfH°gas	-83.87	kJ/mol	Joback Calculated Property
ΔfusH°	16.05	kJ/mol	Joback Calculated Property
ΔvapH°	45.51	kJ/mol	Joback Calculated Property
log10WS	-4.04		Crippen Calculated Property
logPoct/wat	4.154		Crippen Calculated Property
McVol	170.270	ml/mol	McGowan Calculated Property
Pc	2233.41	kPa	Joback Calculated Property
Inp	[1275.00; 1275.00]
Inp	1275.00		NIST
Inp	1275.00		NIST
Inp	1275.00		NIST
Tboil	520.29	K	Joback Calculated Property
Tc	729.27	K	Joback Calculated Property
Tfus	294.27 ± 0.50	K	NIST
Vc	0.644	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[395.64; 492.37]	J/mol×K	[520.29; 729.27]
Cp,gas	395.64	J/mol×K	520.29	Joback Calculated Property
Cp,gas	414.50	J/mol×K	555.12	Joback Calculated Property
Cp,gas	432.19	J/mol×K	589.95	Joback Calculated Property
Cp,gas	448.75	J/mol×K	624.78	Joback Calculated Property
Cp,gas	464.27	J/mol×K	659.61	Joback Calculated Property
Cp,gas	478.79	J/mol×K	694.44	Joback Calculated Property
Cp,gas	492.37	J/mol×K	729.27	Joback Calculated Property
η	[0.0001843; 0.0052309]	Pa×s	[265.11; 520.29]
η	0.0052309	Pa×s	265.11	Joback Calculated Property
η	0.0020371	Pa×s	307.64	Joback Calculated Property
η	0.0009975	Pa×s	350.17	Joback Calculated Property
η	0.0005702	Pa×s	392.70	Joback Calculated Property
η	0.0003636	Pa×s	435.23	Joback Calculated Property
η	0.0002511	Pa×s	477.76	Joback Calculated Property
η	0.0001843	Pa×s	520.29	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, (1,1-diethylpropyl)-.

Sources

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

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