Chemical Properties of 3-Penten-1-ol, 2-methyl- (CAS 62238-37-3)

InChI

InChI=1S/C6H12O/c1-3-4-6(2)5-7/h3-4,6-7H,5H2,1-2H3/b4-3+

InChI Key

ITDXMLZSEZDMFN-ONEGZZNKSA-N

Formula

C6H12O

SMILES

CC=CC(C)CO

Molecular Weight¹

100.16

CAS

62238-37-3

Other Names

• 2-methyl-3-penten-1-ol

• 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 : 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°	-59.40	kJ/mol	Joback Calculated Property
ΔfH°gas	-207.46	kJ/mol	Joback Calculated Property
ΔfusH°	12.06	kJ/mol	Joback Calculated Property
ΔvapH°	45.20	kJ/mol	Joback Calculated Property
log10WS	-1.21		Crippen Calculated Property
logPoct/wat	1.191		Crippen Calculated Property
McVol	96.970	ml/mol	McGowan Calculated Property
Pc	3708.97	kPa	Joback Calculated Property
I	[1374.00; 1380.00]
I	1374.00		NIST
I	1374.00		NIST
I	1380.00		NIST
Tboil	432.58	K	Joback Calculated Property
Tc	605.02	K	Joback Calculated Property
Tfus	198.12	K	Joback Calculated Property
Vc	0.364	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[191.87; 242.44]	J/mol×K	[432.58; 605.02]
Cp,gas	191.87	J/mol×K	432.58	Joback Calculated Property
Cp,gas	201.31	J/mol×K	461.32	Joback Calculated Property
Cp,gas	210.32	J/mol×K	490.06	Joback Calculated Property
Cp,gas	218.92	J/mol×K	518.80	Joback Calculated Property
Cp,gas	227.13	J/mol×K	547.54	Joback Calculated Property
Cp,gas	234.96	J/mol×K	576.28	Joback Calculated Property
Cp,gas	242.44	J/mol×K	605.02	Joback Calculated Property
η	[0.0001926; 0.2423961]	Pa×s	[198.12; 432.58]
η	0.2423961	Pa×s	198.12	Joback Calculated Property
η	0.0276896	Pa×s	237.20	Joback Calculated Property
η	0.0058431	Pa×s	276.27	Joback Calculated Property
η	0.0018131	Pa×s	315.35	Joback Calculated Property
η	0.0007282	Pa×s	354.43	Joback Calculated Property
η	0.0003506	Pa×s	393.50	Joback Calculated Property
η	0.0001926	Pa×s	432.58	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[0.36; 202.64]	kPa	[295.70; 452.28]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.49590e+01
Coefficient B			-3.81371e+03
Coefficient C			-5.69790e+01
Temperature range, min.			295.70
Temperature range, max.			452.28
Pvap	0.36	kPa	295.70	Calculated Property
Pvap	1.07	kPa	313.10	Calculated Property
Pvap	2.76	kPa	330.50	Calculated Property
Pvap	6.36	kPa	347.89	Calculated Property
Pvap	13.32	kPa	365.29	Calculated Property
Pvap	25.79	kPa	382.69	Calculated Property
Pvap	46.70	kPa	400.09	Calculated Property
Pvap	79.86	kPa	417.48	Calculated Property
Pvap	129.96	kPa	434.88	Calculated Property
Pvap	202.64	kPa	452.28	Calculated Property

Similar Compounds

Find more compounds similar to 3-Penten-1-ol, 2-methyl-.

Sources

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

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