Chemical Properties of Tripelennamine

InChI

InChI=1S/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3

InChI Key

UFLGIAIHIAPJJC-UHFFFAOYSA-N

Formula

C16H21N3

SMILES

CN(C)CCN(Cc1ccccc1)c1ccccn1

Molecular Weight¹

255.37

Other Names

• 1,2-Ethanediamine, N,N-dimethyl-N'-(phenylmethyl)-N'-2-pyridinyl-
• 2-(N-Benzyl-N-(2-dimethylaminoethyl)amino)pyridine
• 2-[Benzyl(2-Dimethylaminoethyl)amino]pyridine
• 2750 R.P.
• Benzoxale
• Benzyl-«alpha»-pyridyl-dimethyl-aethylendiamin
• Cizaron
• Ethylenediamine, N-benzyl-N',N'-dimethyl-N-(2-pyridyl)-
• N,N-Dimethyl-N'-benzyl-N'-(2-pyridyl)ethylenediamine
• N,N-Dimethyl-N'-benzyl-N'-(«alpha»-pyridyl)ethylenediamine
• N-Benzyl-N',N'-dimethyl-N-(2-pyridyl)ethylenediamine
• N-Benzyl-N-(2-pyridyl)-N',N'-dimethyl ethylenediamine
• NCI-C60662
• NSC 118946
• PBZ
• Piribenzil
• Pyribenzamin
• Pyribenzamine
• Pyridbenzamine
• Pyridine, 2-[benzyl[2-(dimethylamino)ethyl]amino]-
• Pyrinamine base
• Pyristine (piristina)
• Resistamine
• Tonaril
• Tripelannamine
• Tripelenamine
• Tripelennamin
• Tripelennamina
• Tripellenamine
• Triplennamine
• «beta»-Dimethylaminoethyl-2-pyridylaminotoluene
• «beta»-Dimethylaminoethyl-2-pyridylbenzylamine

• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔvapH°	92.60	kJ/mol	Relay (1.0) Calculated Property
IE	8.19	eV	Relay (1.0) Calculated Property
log10WS	-2.64		Aq. Solubility Prediction
logPoct/wat	2.650		Crippen Calculated Property
McVol	218.720	ml/mol	McGowan Calculated Property
Inp	[1949.00; 1980.00]
Inp	1974.00		NIST
Inp	1980.00		NIST
Inp	1960.00		NIST
Inp	1960.00		NIST
Inp	1961.00		NIST
Inp	1961.00		NIST
Inp	Outlier 1949.00		NIST
Inp	1975.00		NIST
Inp	1976.00		NIST
Inp	1970.00		NIST
Inp	1975.00		NIST
Inp	1975.00		NIST
Inp	1980.00		NIST
Inp	Outlier 1949.00		NIST
Inp	1980.00		NIST
Inp	1980.00		NIST
Inp	1974.00		NIST
Inp	1961.00		NIST
Inp	1980.00		NIST
Inp	1976.00		NIST
Inp	1970.00		NIST
I	[2682.00; 2682.00]
I	2682.00		NIST
I	2682.00		NIST
Tboil	628.32	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor 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.

Similar Compounds

Find more compounds similar to Tripelennamine.

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
• Aqueous Solubility Prediction 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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
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