Chemical Properties of [3-(10,11-Dihydro-dibenzo[b,f]azepin-5-yl)-2-methyl-propyl]-methyl-amine

InChI

InChI=1S/C19H24N2/c1-14(13-20-2)11-16-12-15-7-3-5-9-18(15)21-19-10-6-4-8-17(16)19/h3-10,14,16,20-21H,11-13H2,1-2H3

InChI Key

LIPVJONNKBYLTO-UHFFFAOYSA-N

Formula

C19H24N2

SMILES

CNCC(C)CC1Cc2ccccc2Nc2ccccc21

Molecular Weight¹

280.41

• 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.
• 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	0.6621		Relay (... Calculated Property
ΔfG°	550.07	kJ/mol	Joback Calculated Property
ΔfH°gas	119.10	kJ/mol	Relay (... Calculated Property
ΔfusH°	41.57	kJ/mol	Joback Calculated Property
ΔvapH°	113.15	kJ/mol	Relay (... Calculated Property
IE	7.11	eV	Relay (... Calculated Property
log10WS	-3.85		Relay (... Calculated Property
logPoct/wat	4.316		Crippen Calculated Property
McVol	240.150	ml/mol	McGowan Calculated Property
Pc	2003.70	kPa	Joback Calculated Property
Inp	[2270.00; 2270.00]
Inp	2270.00		NIST
Inp	2270.00		NIST
Tboil	681.25	K	Relay (... Calculated Property
Tc	971.57	K	Relay (... Calculated Property
Tfus	407.94	K	Relay (... Calculated Property
Vc	0.830	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[726.73; 817.59]	J/mol×K	[802.46; 1039.98]
Cp,gas	726.73	J/mol×K	802.46	Joback Calculated Property
Cp,gas	744.73	J/mol×K	842.05	Joback Calculated Property
Cp,gas	761.44	J/mol×K	881.63	Joback Calculated Property
Cp,gas	776.98	J/mol×K	921.22	Joback Calculated Property
Cp,gas	791.44	J/mol×K	960.81	Joback Calculated Property
Cp,gas	804.94	J/mol×K	1000.40	Joback Calculated Property
Cp,gas	817.59	J/mol×K	1039.98	Joback Calculated Property

Similar Compounds

Find more compounds similar to [3-(10,11-Dihydro-dibenzo[b,f]azepin-5-yl)-2-methyl-propyl]-methyl-amine.

Sources

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

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