Chemical Properties of M-IODOPHENOL

InChI

InChI=1S/C6H5IO/c7-5-2-1-3-6(8)4-5/h1-4,8H

InChI Key

FXTKWBZFNQHAAO-UHFFFAOYSA-N

Formula

C6H5IO

SMILES

Oc1cccc(I)c1

Molecular Weight¹

220.01

Other Names

• 3-Iodophenol
• 3-Jodphenol
• Phenol, m-iodo-
• m-Hydroxyiodobenzene

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• 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).
• 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).
• 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	0.4559		Relay (1.0) Calculated Property
ΔcH°solid	-2981.10 ± 4.20	kJ/mol	NIST
ΔfG°	15.55	kJ/mol	Joback Calculated Property
ΔfH°gas	0.63	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	15.53	kJ/mol	Joback Calculated Property
ΔvapH°	72.74	kJ/mol	Relay (1.0) Calculated Property
IE	8.40	eV	Relay (1.0) Calculated Property
log10WS	-1.76		Relay (1.0) Calculated Property
logPoct/wat	1.997		Crippen Calculated Property
McVol	103.330	ml/mol	McGowan Calculated Property
Pc	5602.57	kPa	Joback Calculated Property
Inp	[1369.00; 1369.00]
Inp	1369.00		NIST
Inp	1369.00		NIST
Inp	1369.00		NIST
Inp	1369.00		NIST
Tboil	536.00	K	Relay (1.0) Calculated Property
Tc	821.72	K	Relay (1.0) Calculated Property
Tfus	341.13	K	Relay (1.0) Calculated Property
Vc	0.321	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[182.49; 220.71]	J/mol×K	[537.32; 808.64]
Cp,gas	182.49	J/mol×K	537.32	Joback Calculated Property
Cp,gas	190.62	J/mol×K	582.54	Joback Calculated Property
Cp,gas	197.86	J/mol×K	627.76	Joback Calculated Property
Cp,gas	204.35	J/mol×K	672.98	Joback Calculated Property
Cp,gas	210.22	J/mol×K	718.20	Joback Calculated Property
Cp,gas	215.63	J/mol×K	763.42	Joback Calculated Property
Cp,gas	220.71	J/mol×K	808.64	Joback Calculated Property
η	[0.0000913; 0.0035242]	Pa×s	[353.58; 537.32]
η	0.0035242	Pa×s	353.58	Joback Calculated Property
η	0.0015041	Pa×s	384.20	Joback Calculated Property
η	0.0007280	Pa×s	414.83	Joback Calculated Property
η	0.0003893	Pa×s	445.45	Joback Calculated Property
η	0.0002256	Pa×s	476.07	Joback Calculated Property
η	0.0001397	Pa×s	506.70	Joback Calculated Property
η	0.0000913	Pa×s	537.32	Joback Calculated Property
ΔvapH	88.40	kJ/mol	298.15	Experimental and Computational Thermochemical Study of the Three Monoiodophenol Isomers

Similar Compounds

Find more compounds similar to M-IODOPHENOL.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Experimental and Computational Thermochemical Study of the Three Monoiodophenol Isomers
• Joback Method
• McGowan Method
• NIST Webbook

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