Chemical Properties of Propane, 1,3-dichloro-2-methyl- (CAS 616-19-3)

InChI

InChI=1S/C4H8Cl2/c1-4(2-5)3-6/h4H,2-3H2,1H3

InChI Key

VENSUTAUIFXSRD-UHFFFAOYSA-N

Formula

C4H8Cl2

SMILES

CC(CCl)CCl

Molecular Weight¹

127.01

CAS

616-19-3

Other Names

• 1,3-Dichloro-2-methylpropane
• 1,3-Dichloroisobutane

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• P_vap : Vapor pressure (kPa).
• I_np : Non-polar retention indices.
• 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
ΔfG°	-43.50	kJ/mol	Joback Calculated Property
ΔfH°gas	-162.65	kJ/mol	Joback Calculated Property
ΔfusH°	10.99	kJ/mol	Joback Calculated Property
ΔvapH°	32.88	kJ/mol	Joback Calculated Property
log10WS	-1.56		Crippen Calculated Property
logPoct/wat	2.100		Crippen Calculated Property
McVol	91.700	ml/mol	McGowan Calculated Property
Pc	3594.25	kPa	Joback Calculated Property
Inp	[810.00; 820.00]
Inp	810.00		NIST
Inp	820.00		NIST
Inp	820.00		NIST
Tboil	365.34	K	Joback Calculated Property
Tc	551.71	K	Joback Calculated Property
Tfus	179.68	K	Joback Calculated Property
Vc	0.351	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[141.59; 182.54]	J/mol×K	[365.34; 551.71]
Cp,gas	141.59	J/mol×K	365.34	Joback Calculated Property
Cp,gas	149.22	J/mol×K	396.40	Joback Calculated Property
Cp,gas	156.51	J/mol×K	427.46	Joback Calculated Property
Cp,gas	163.48	J/mol×K	458.52	Joback Calculated Property
Cp,gas	170.14	J/mol×K	489.58	Joback Calculated Property
Cp,gas	176.48	J/mol×K	520.65	Joback Calculated Property
Cp,gas	182.54	J/mol×K	551.71	Joback Calculated Property
η	[0.0003376; 0.0069129]	Pa×s	[179.68; 365.34]
η	0.0069129	Pa×s	179.68	Joback Calculated Property
η	0.0028879	Pa×s	210.62	Joback Calculated Property
η	0.0015088	Pa×s	241.57	Joback Calculated Property
η	0.0009135	Pa×s	272.51	Joback Calculated Property
η	0.0006126	Pa×s	303.45	Joback Calculated Property
η	0.0004424	Pa×s	334.40	Joback Calculated Property
η	0.0003376	Pa×s	365.34	Joback Calculated Property
ΔvapH	45.10	kJ/mol	339.00	NIST

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[306.78; 417.17]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.47516e+01
Coefficient B			-3.00016e+03
Coefficient C			-9.93590e+01
Temperature range, min.			306.78
Temperature range, max.			417.17
Pvap	1.33	kPa	306.78	Calculated Property
Pvap	2.99	kPa	319.05	Calculated Property
Pvap	6.15	kPa	331.31	Calculated Property
Pvap	11.78	kPa	343.58	Calculated Property
Pvap	21.21	kPa	355.84	Calculated Property
Pvap	36.17	kPa	368.11	Calculated Property
Pvap	58.87	kPa	380.37	Calculated Property
Pvap	92.01	kPa	392.64	Calculated Property
Pvap	138.74	kPa	404.90	Calculated Property
Pvap	202.66	kPa	417.17	Calculated Property

Similar Compounds

Find more compounds similar to Propane, 1,3-dichloro-2-methyl-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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