Chemical Properties of N,N-Bis[(hydroxyethyl)trimethylene]diamine (CAS 4985-85-7)

N,N-Bis[(hydroxyethyl)trimethylene]diamine

InChI
InChI=1S/C7H18N2O2/c8-2-1-3-9(4-6-10)5-7-11/h10-11H,1-8H2
InChI Key
FKJVYOFPTRGCSP-UHFFFAOYSA-N
Formula
C7H18N2O2
SMILES
NCCCN(CCO)CCO
Molecular Weight1
162.23
CAS
4985-85-7
Other Names
  • Ethanol, 2,2'-[(3-aminopropyl)imino]bis-
  • Aminopropyldiethanolamine
  • Ethanol, 2,2'-(aminopropylimino)-
  • Ethanol, 2,2'-((3-aminopropyl)imino)di-
  • N-(3-Aminopropyl)diethanolamine
  • N,N-Bis(hydroxyethyl)-1,3-propanediamine
  • N,N-Bis(2-hydroxyethyl)-1,3-propanediamine
  • N,N-Di(2-hydroxyethyl)-1,3-propanediamine
  • 2,2'-((3-Aminopropyl)imino)diethanol
  • (3-Aminopropyl)diethanolamine
  • NSC 8172
  • N-(3-aminopropyl)iminodiethanol
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Physical Properties

Property Value Unit Source
ΔfH°gas -400.10 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 30.28 kJ/mol Joback Calculated Property
ΔvapH° 95.54 kJ/mol Relay (1.0) Calculated Property
IE 8.54 eV Relay (1.0) Calculated Property
logPoct/wat -1.378 Crippen Calculated Property
McVol 141.190 ml/mol McGowan Calculated Property
Tboil 480.00 K NIST
Tfus 284.74 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [391.10; 444.21] J/mol×K [629.09; 795.36] Show Hide
Cp,gas 391.10 J/mol×K 629.09 Joback Calculated Property
Cp,gas 401.04 J/mol×K 656.80 Joback Calculated Property
Cp,gas 410.52 J/mol×K 684.51 Joback Calculated Property
Cp,gas 419.55 J/mol×K 712.23 Joback Calculated Property
Cp,gas 428.17 J/mol×K 739.94 Joback Calculated Property
Cp,gas 436.38 J/mol×K 767.65 Joback Calculated Property
Cp,gas 444.21 J/mol×K 795.36 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 440.50 ± 2.50 K 0.30 NIST

Similar Compounds

4-Morpholinepropanamine. 2-(dipropylamino)ethanol. N,N-DIETHYL-1,3-PROPANEDIAMINE. 1,3-Propanediamine, N-(3-aminopropyl)-N-methyl-. Ethanol, 2,2'-(butylimino)bis-. 2-(DIBUTYLAMINO)ETHANOL. 1-(2-HYDROXYETHYL)PYRROLIDINE. 1,3-Propanediamine, N,N-dibutyl-. 1-Piperidineethanol. 2-Propanol, 1-[bis(2-hydroxyethyl)amino]-. 1,4-Bis(3-aminopropyl)piperazine. 1,1'-[(2-hydroxyethyl)imino]dipropan-2-ol. N-(.beta.-Hydroxyethyl)hexamethyleneimine. n-Hexyl-2,2'-iminodiethanol. Ethanol, 2,2'-(dodecylimino)bis-.

Find more compounds similar to N,N-Bis[(hydroxyethyl)trimethylene]diamine.

Sources

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