Chemical Properties of 1-Butene, 1-chloro-3-methyl- (CAS 23010-00-6)

InChI

InChI=1S/C5H9Cl/c1-5(2)3-4-6/h3-5H,1-2H3/b4-3+

InChI Key

MXVSJNLRVLKAOG-ONEGZZNKSA-N

Formula

C5H9Cl

SMILES

CC(C)C=CCl

Molecular Weight¹

104.58

CAS

23010-00-6

Other Names

• 1-Chloro-3-methyl-1-butene
• 3-Methyl-1-chloro-1-butene
• «beta»-Isopropylvinyl chloride
• «beta»-Isopropylvinyl chloride

• 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°	57.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-50.33	kJ/mol	Joback Calculated Property
ΔfusH°	9.58	kJ/mol	Joback Calculated Property
ΔvapH°	30.68	kJ/mol	Joback Calculated Property
log10WS	-2.18		Crippen Calculated Property
logPoct/wat	2.395		Crippen Calculated Property
McVol	89.250	ml/mol	McGowan Calculated Property
Pc	3564.27	kPa	Joback Calculated Property
Inp	[661.00; 668.00]
Inp	661.00		NIST
Inp	663.00		NIST
Inp	668.00		NIST
Tboil	354.95	K	Joback Calculated Property
Tc	541.48	K	Joback Calculated Property
Tfus	155.95	K	Joback Calculated Property
Vc	0.339	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[136.80; 184.64]	J/mol×K	[354.95; 541.48]
Cp,gas	136.80	J/mol×K	354.95	Joback Calculated Property
Cp,gas	145.84	J/mol×K	386.04	Joback Calculated Property
Cp,gas	154.44	J/mol×K	417.13	Joback Calculated Property
Cp,gas	162.59	J/mol×K	448.21	Joback Calculated Property
Cp,gas	170.33	J/mol×K	479.30	Joback Calculated Property
Cp,gas	177.68	J/mol×K	510.39	Joback Calculated Property
Cp,gas	184.64	J/mol×K	541.48	Joback Calculated Property
η	[0.0002299; 0.0074259]	Pa×s	[155.95; 354.95]
η	0.0074259	Pa×s	155.95	Joback Calculated Property
η	0.0025041	Pa×s	189.12	Joback Calculated Property
η	0.0011680	Pa×s	222.28	Joback Calculated Property
η	0.0006641	Pa×s	255.45	Joback Calculated Property
η	0.0004299	Pa×s	288.62	Joback Calculated Property
η	0.0003044	Pa×s	321.78	Joback Calculated Property
η	0.0002299	Pa×s	354.95	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[266.12; 405.74]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.34019e+01
Coefficient B			-2.94873e+03
Coefficient C			-4.12720e+01
Temperature range, min.			266.12
Temperature range, max.			405.74
Pvap	1.33	kPa	266.12	Calculated Property
Pvap	3.11	kPa	281.63	Calculated Property
Pvap	6.54	kPa	297.15	Calculated Property
Pvap	12.64	kPa	312.66	Calculated Property
Pvap	22.74	kPa	328.17	Calculated Property
Pvap	38.52	kPa	343.69	Calculated Property
Pvap	62.00	kPa	359.20	Calculated Property
Pvap	95.45	kPa	374.71	Calculated Property
Pvap	141.42	kPa	390.23	Calculated Property
Pvap	202.64	kPa	405.74	Calculated Property

Similar Compounds

Find more compounds similar to 1-Butene, 1-chloro-3-methyl-.

Sources

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

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