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Tetraethylenepentamine
CAS: 112-57-2 | C8H23N5
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
112-57-2
Molecular Formula:
C8H23N5
Molecular Mass:
189.31 g/mol
Names and Synonyms:
Tetraethylenepentamine
1,2-Ethanediamine, N1-(2-aminoethyl)-N2-[2-[(2-aminoethyl)amino]ethyl]-
Tetraethylenepentamine
1,2-Ethanediamine, N-(2-aminoethyl)-N′-[2-[(2-aminoethyl)amino]ethyl]-
N1-(2-Aminoethyl)-N2-[2-[(2-aminoethyl)amino]ethyl]-1,2-ethanediamine
3,6,9-Triazaundecane-1,11-diamine
1,11-Diamino-3,6,9-triazaundecane
Tetren
TEP
1,4,7,10,13-Pentaazatridecane
Tetraethylpentylamine
DEH 26
3,6,9-Triaza-1,11-diaminoundecane
Ancamine TEPA
TEPA
NSC 88603
N-(2-Aminoethyl)-N′-(2-((2-aminoethyl)amino)ethyl)-1,2-ethanediamine
T 11509
Bis[2-(2-aminoethylamino)ethyl]amine
AFR-AN 6
TH 160
Insulcure 9
Epikure 927
Epikure Curing Agent 927
Tetraethylene pentaamine
Identifiers:
SMILES:
NCCNCCNCCNCCN
InChI:
InChI=1S/C8H23N5/c9-1-3-11-5-7-13-8-6-12-4-2-10/h11-13H,1-10H2
Key Properties
Boiling Point
340.30 °C @ Press: 760 Torr
CAS Common Chemistry
Melting Point
-30 °C
CAS Common Chemistry
Density
1.00 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 189.31 g/mol | CAS Common Chemistry |
| 189.307 g/mol | RDKit | |
| 189.19534573599998 g/mol | RDKit | |
| Density | 1.00 g/cm³ | CAS Common Chemistry |
| 0.9980 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Tetraethylenepentamine | CAS Common Chemistry |
| Boiling Point | 340.30 °C @ Press: 760 Torr | CAS Common Chemistry |
| Canonical SMILES | NCCNCCNCCNCCN | CAS Common Chemistry |
| InChI | InChI=1S/C8H23N5/c9-1-3-11-5-7-13-8-6-12-4-2-10/h11-13H,1-10H2 | CAS Common Chemistry |
| InChI Key | InChIKey=FAGUFWYHJQFNRV-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -30 °C | CAS Common Chemistry |
| Name | Tetraethylenepentamine | CAS Common Chemistry |
| Heavy Atom Count | 13 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 5 | RDKit |
| Rotatable Bonds | 10 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 88.13 Ų | RDKit |
| LogP | -2.3273999999999972 | RDKit |
| Molar Refractivity | 56.71790000000002 | RDKit |
