Chemical Properties of Butane, 1,1-dichloro-3,3-dimethyl- (CAS 6130-96-7)

InChI

InChI=1S/C6H12Cl2/c1-6(2,3)4-5(7)8/h5H,4H2,1-3H3

InChI Key

BLRPQFOUUPCTED-UHFFFAOYSA-N

Formula

C6H12Cl2

SMILES

CC(C)(C)CC(Cl)Cl

Molecular Weight¹

155.06

CAS

6130-96-7

Other Names

• 1,1-dichloro-3,3-dimethylbutane

• 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).
• 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
ΔfG°	-23.82	kJ/mol	Joback Calculated Property
ΔfH°gas	-212.68	kJ/mol	Joback Calculated Property
ΔfusH°	8.75	kJ/mol	Joback Calculated Property
ΔvapH°	36.04	kJ/mol	Joback Calculated Property
log10WS	-3.01		Crippen Calculated Property
logPoct/wat	3.226		Crippen Calculated Property
McVol	119.880	ml/mol	McGowan Calculated Property
Pc	2950.48	kPa	Joback Calculated Property
Inp	[871.00; 871.00]
Inp	871.00		NIST
Inp	871.00		NIST
Tboil	[420.20; 423.00]	K
Tboil	420.20	K	NIST
Tboil	423.00 ± 2.00	K	NIST
Tc	604.68	K	Joback Calculated Property
Tfus	[212.85; 217.00]	K
Tfus	212.85 ± 0.60	K	NIST
Tfus	217.00 ± 4.00	K	NIST
Vc	0.453	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[214.30; 275.45]	J/mol×K	[407.87; 604.68]
Cp,gas	214.30	J/mol×K	407.87	Joback Calculated Property
Cp,gas	226.11	J/mol×K	440.67	Joback Calculated Property
Cp,gas	237.23	J/mol×K	473.47	Joback Calculated Property
Cp,gas	247.69	J/mol×K	506.27	Joback Calculated Property
Cp,gas	257.53	J/mol×K	539.07	Joback Calculated Property
Cp,gas	266.77	J/mol×K	571.88	Joback Calculated Property
Cp,gas	275.45	J/mol×K	604.68	Joback Calculated Property
η	[0.0003425; 0.0130916]	Pa×s	[204.64; 407.87]
η	0.0130916	Pa×s	204.64	Joback Calculated Property
η	0.0046345	Pa×s	238.51	Joback Calculated Property
η	0.0021241	Pa×s	272.38	Joback Calculated Property
η	0.0011569	Pa×s	306.25	Joback Calculated Property
η	0.0007112	Pa×s	340.13	Joback Calculated Property
η	0.0004775	Pa×s	374.00	Joback Calculated Property
η	0.0003425	Pa×s	407.87	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.67]	kPa	[321.88; 443.18]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.62320e+01
Coefficient B			-4.20398e+03
Coefficient C			-5.82160e+01
Temperature range, min.			321.88
Temperature range, max.			443.18
Pvap	1.33	kPa	321.88	Calculated Property
Pvap	2.90	kPa	335.36	Calculated Property
Pvap	5.85	kPa	348.84	Calculated Property
Pvap	11.11	kPa	362.31	Calculated Property
Pvap	19.97	kPa	375.79	Calculated Property
Pvap	34.23	kPa	389.27	Calculated Property
Pvap	56.26	kPa	402.75	Calculated Property
Pvap	89.06	kPa	416.22	Calculated Property
Pvap	136.37	kPa	429.70	Calculated Property
Pvap	202.67	kPa	443.18	Calculated Property

Similar Compounds

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

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.