Chemical Properties of N-Isopropyl-N-propyl aminoethyl-2-chloride

InChI

InChI=1S/C8H18ClN/c1-4-6-10(7-5-9)8(2)3/h8H,4-7H2,1-3H3

InChI Key

WUYUGBPLXZIKGW-UHFFFAOYSA-N

Formula

C8H18ClN

SMILES

CCCN(CCCl)C(C)C

Molecular Weight¹

163.69

Other Names

• ethanamine, 2-chloro, N-propyl, N-isopropyl

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-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
ΔfusH°	20.17	kJ/mol	Joback Calculated Property
logPoct/wat	2.346		Crippen Calculated Property
McVol	145.800	ml/mol	McGowan Calculated Property
Inp	[1065.40; 1065.40]
Inp	1065.40		NIST
Inp	1065.40		NIST
Tboil	451.74	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, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[203.79; 478.89]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-3.86600e+00
Coefficient B			9.00460e-01
Coefficient C			-5.47600e-04
Coefficient D			1.29900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	203.79	J/mol×K	273.00	Calculated Property
Cp,gas	251.91	J/mol×K	353.78	Calculated Property
Cp,gas	294.69	J/mol×K	434.56	Calculated Property
Cp,gas	332.52	J/mol×K	515.33	Calculated Property
Cp,gas	365.84	J/mol×K	596.11	Calculated Property
Cp,gas	395.03	J/mol×K	676.89	Calculated Property
Cp,gas	420.53	J/mol×K	757.67	Calculated Property
Cp,gas	442.73	J/mol×K	838.44	Calculated Property
Cp,gas	462.05	J/mol×K	919.22	Calculated Property
Cp,gas	478.89	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to N-Isopropyl-N-propyl aminoethyl-2-chloride.

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
• Joback 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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