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2-[2-(2-Aminoethoxy)Ethoxy]Ethanol
CAS: 6338-55-2 | C6H15NO3
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
6338-55-2
Molecular Formula:
C6H15NO3
Molecular Mass:
149.19 g/mol
Names and Synonyms:
2-[2-(2-Aminoethoxy)Ethoxy]Ethanol
Ethanol, 2-[2-(2-aminoethoxy)ethoxy]-
2-[2-(2-Aminoethoxy)ethoxy]ethanol
Triethylene glycol monoamine
T3EGMA
8-Amino-3,6-dioxa-1-octanol
Triglycolamine
MA 10
NSC 40760
8-Amino-3,6-dioxaoctanol
2-[2-(2-Hydroxyethoxy)ethoxy]ethylamine
3,6,9-Trioxadecylamine
2-[2-(2-Aminoethoxy)ethoxy]ethan-1-ol
Identifiers:
SMILES:
NCCOCCOCCO
InChI:
InChI=1S/C6H15NO3/c7-1-3-9-5-6-10-4-2-8/h8H,1-7H2
Key Properties
Boiling Point
120-130 °C @ Press: 4 Torr
CAS Common Chemistry
Density
1.08 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 | 149.19 g/mol | CAS Common Chemistry |
| 149.10519334 g/mol | RDKit | |
| Density | 1.08 g/cm³ | CAS Common Chemistry |
| 1.0773 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Boiling Point | 120-130 °C @ Press: 4 Torr | CAS Common Chemistry |
| Canonical SMILES | OCCOCCOCCN | CAS Common Chemistry |
| InChI | InChI=1S/C6H15NO3/c7-1-3-9-5-6-10-4-2-8/h8H,1-7H2 | CAS Common Chemistry |
| InChI Key | InChIKey=ASDQMECUMYIVBG-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-[2-(2-Aminoethoxy)ethoxy]ethanol | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 7 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 64.71000000000001 Ų | RDKit |
| LogP | -1.0294 | RDKit |
| Molar Refractivity | 37.778200000000005 | RDKit |
