Chemical Properties of 6-ethoxy-dihydroindole

InChI

InChI=1S/C10H13NO/c1-2-12-9-4-3-8-5-6-11-10(8)7-9/h3-4,7,11H,2,5-6H2,1H3

InChI Key

VNQYYRLBJAYXLB-UHFFFAOYSA-N

Formula

C10H13NO

SMILES

CCOc1ccc2c(c1)NCC2

Molecular Weight¹

163.22

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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	0.5391		Relay (1.0) Calculated Property
ΔfG°	177.64	kJ/mol	Joback Calculated Property
ΔfH°gas	-97.77	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.76	kJ/mol	Joback Calculated Property
ΔvapH°	71.48	kJ/mol	Relay (1.0) Calculated Property
IE	7.29	eV	Relay (1.0) Calculated Property
log10WS	-2.77		Relay (1.0) Calculated Property
logPoct/wat	2.053		Crippen Calculated Property
McVol	132.990	ml/mol	McGowan Calculated Property
Pc	3435.91	kPa	Joback Calculated Property
Inp	[1565.00; 1572.00]
Inp	1565.00		NIST
Inp	1572.00		NIST
Inp	1565.00		NIST
I	[2424.00; 2434.00]
I	2424.00		NIST
I	2434.00		NIST
Tboil	562.46	K	Relay (1.0) Calculated Property
Tc	786.20	K	Relay (1.0) Calculated Property
Tfus	357.47	K	Relay (1.0) Calculated Property
Vc	0.494	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[307.64; 382.86]	J/mol×K	[547.22; 774.61]
Cp,gas	307.64	J/mol×K	547.22	Joback Calculated Property
Cp,gas	322.23	J/mol×K	585.12	Joback Calculated Property
Cp,gas	335.95	J/mol×K	623.02	Joback Calculated Property
Cp,gas	348.83	J/mol×K	660.91	Joback Calculated Property
Cp,gas	360.91	J/mol×K	698.81	Joback Calculated Property
Cp,gas	372.24	J/mol×K	736.71	Joback Calculated Property
Cp,gas	382.86	J/mol×K	774.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to 6-ethoxy-dihydroindole.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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