Chemical Properties of 1,2-Ethanediol, 1-(2-furanyl)- (CAS 19377-75-4)

InChI

InChI=1S/C6H8O3/c7-4-5(8)6-2-1-3-9-6/h1-3,5,7-8H,4H2

InChI Key

YOSOKWRRCVPEJS-UHFFFAOYSA-N

Formula

C6H8O3

SMILES

OCC(O)c1ccco1

Molecular Weight¹

128.13

CAS

19377-75-4

Other Names

• 1-(2-Furyl)-1,2-ethanediol
• 1-(2-Furanyl)-1,2-ethanediol

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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).
• I_np : Non-polar retention indices.
• 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
ω	0.7192		Relay (... Calculated Property
ΔfG°	-246.30	kJ/mol	Relay (... Calculated Property ⚠️
ΔfH°gas	-414.80	kJ/mol	Relay (... Calculated Property
ΔvapH°	82.98	kJ/mol	Relay (... Calculated Property
IE	9.14	eV	Relay (... Calculated Property
log10WS	0.39		Relay (... Calculated Property
logPoct/wat	0.305		Crippen Calculated Property
McVol	93.550	ml/mol	McGowan Calculated Property
Pc	4608.59	kPa	Relay (... Calculated Property ⚠️
Inp	[1099.00; 1099.00]
Inp	1099.00		NIST
Inp	1099.00		NIST
I	2554.00		NIST
Tboil	522.56	K	Relay (... Calculated Property
Tc	751.53	K	Relay (... Calculated Property
Tfus	318.61	K	Relay (... Calculated Property
Vc	0.357	m3/kmol	Relay (... Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Ethanediol, 1-(2-furanyl)-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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