Chemical Properties of Butane, 1,3-dichloro-2-methyl- (CAS 23010-07-3)

InChI

InChI=1S/C5H10Cl2/c1-4(3-6)5(2)7/h4-5H,3H2,1-2H3

InChI Key

MCAJTVAYCDZHHF-UHFFFAOYSA-N

Formula

C5H10Cl2

SMILES

CC(Cl)C(C)CCl

Molecular Weight¹

141.04

CAS

23010-07-3

Other Names

• 1,3-Dichloro-2-methylbutane

• 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).
• P_vap : Vapor 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	0.3029		Relay (1.0) Calculated Property
ΔfG°	-37.52	kJ/mol	Joback Calculated Property
ΔfH°gas	-223.83	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	10.05	kJ/mol	Joback Calculated Property
ΔvapH°	43.14	kJ/mol	Relay (1.0) Calculated Property
IE	10.08	eV	Relay (1.0) Calculated Property
log10WS	-2.59		Relay (1.0) Calculated Property
logPoct/wat	2.489		Crippen Calculated Property
McVol	105.790	ml/mol	McGowan Calculated Property
Pc	3243.03	kPa	Joback Calculated Property
Inp	[869.00; 874.00]
Inp	869.00		NIST
Inp	874.00		NIST
Tboil	420.13	K	Relay (1.0) Calculated Property
Tc	619.94	K	Relay (1.0) Calculated Property
Tfus	206.93	K	Relay (1.0) Calculated Property
Vc	0.373	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[175.68; 226.08]	J/mol×K	[387.78; 577.75]
Cp,gas	175.68	J/mol×K	387.78	Joback Calculated Property
Cp,gas	185.11	J/mol×K	419.44	Joback Calculated Property
Cp,gas	194.11	J/mol×K	451.10	Joback Calculated Property
Cp,gas	202.69	J/mol×K	482.77	Joback Calculated Property
Cp,gas	210.87	J/mol×K	514.43	Joback Calculated Property
Cp,gas	218.66	J/mol×K	546.09	Joback Calculated Property
Cp,gas	226.08	J/mol×K	577.75	Joback Calculated Property
η	[0.0003189; 0.0132129]	Pa×s	[175.95; 387.78]
η	0.0132129	Pa×s	175.95	Joback Calculated Property
η	0.0042286	Pa×s	211.25	Joback Calculated Property
η	0.0018754	Pa×s	246.56	Joback Calculated Property
η	0.0010197	Pa×s	281.87	Joback Calculated Property
η	0.0006349	Pa×s	317.17	Joback Calculated Property
η	0.0004347	Pa×s	352.48	Joback Calculated Property
η	0.0003189	Pa×s	387.78	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[312.92; 449.70]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.47169e+01
Coefficient B			-3.69507e+03
Coefficient C			-5.68400e+01
Temperature range, min.			312.92
Temperature range, max.			449.70
Pvap	1.33	kPa	312.92	Calculated Property
Pvap	2.99	kPa	328.12	Calculated Property
Pvap	6.16	kPa	343.32	Calculated Property
Pvap	11.80	kPa	358.51	Calculated Property
Pvap	21.24	kPa	373.71	Calculated Property
Pvap	36.22	kPa	388.91	Calculated Property
Pvap	58.94	kPa	404.11	Calculated Property
Pvap	92.08	kPa	419.30	Calculated Property
Pvap	138.78	kPa	434.50	Calculated Property
Pvap	202.63	kPa	449.70	Calculated Property

Similar Compounds

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

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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