Chemical Properties of 1,2,3,4-Tetrahydro-N-methylcarbazole

InChI

InChI=1S/C13H15N/c1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2,4,6,8H,3,5,7,9H2,1H3

InChI Key

LXRZSWPAXJBXQM-UHFFFAOYSA-N

Formula

C13H15N

SMILES

Cn1c2c(c3ccccc31)CCCC2

Molecular Weight¹

185.27

Other Names

• 2,3,4,9-Tetrahydro-9-methyl-1H-carbazole
• N-methyl-tetrahydrocarbazole

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,solid : Solid phase heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_subH° : Enthalpy of sublimation 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_p : Polar retention indices.
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5115		PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
ΔcH°solid	-7258.30 ± 1.10	kJ/mol	NIST
ΔfH°gas	93.10 ± 0.30	kJ/mol	NIST
ΔfH°solid	-1.00 ± 1.30	kJ/mol	NIST
ΔsubH°	94.10	kJ/mol	NIST
ΔvapH°	78.80	kJ/mol	Relay (1.0) Calculated Property
IE	7.35	eV	Relay (1.0) Calculated Property
log10WS	-3.30		Relay (1.0) Calculated Property
logPoct/wat	3.057		Crippen Calculated Property
McVol	154.230	ml/mol	McGowan Calculated Property
Pc	2709.00	kPa	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Inp	[1838.00; 1838.00]
Inp	1838.00		NIST
Inp	1838.00		NIST
Ip	[2651.00; 2709.00]
Ip	2651.00		NIST
Ip	2709.00		NIST
Ip	2651.00		NIST
S°solid,1 bar	[260.89; 260.89]	J/mol×K
S°solid,1 bar	260.89	J/mol×K	NIST
S°solid,1 bar	260.89	J/mol×K	NIST
Tc	854.00	K	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value
Tfus	326.15	K	Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value
Ttriple	323.71 ± 0.01	K	NIST
Vc	0.600	m3/kmol	PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value

Cheméo can also estimate Normal Boiling Point Temperature, Standard Gibbs free energy of formation for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,solid	[241.35; 241.35]	J/mol×K	[298.15; 298.15]
Cp,solid	241.35	J/mol×K	298.15	NIST
Cp,solid	241.35	J/mol×K	298.15	NIST

Similar Compounds

Find more compounds similar to 1,2,3,4-Tetrahydro-N-methylcarbazole.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• PSRK revision IV (2005), critical constants and acentric factors of 1000 components ChEDL chemicals 1.5.2, from Horstmann, S.; Jabłoniec, A.; Krafczyk, J.; Fischer, K.; Gmehling, J. PSRK Group Contribution Equation of State: Comprehensive Revision and Extension IV, Including Critical Constants and α-Function Parameters for 1000 Components. Fluid Phase Equilib. 2005, 227, 157-164.
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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