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2-[2-[2-(2-Aminoethoxy)Ethoxy]Ethoxy]Ethanol
CAS: 86770-74-3 | C8H19NO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
86770-74-3
Molecular Formula:
C8H19NO4
Molecular Mass:
193.24 g/mol
Names and Synonyms:
2-[2-[2-(2-Aminoethoxy)Ethoxy]Ethoxy]Ethanol
Ethanol, 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]-
2-[2-[2-(2-Aminoethoxy)ethoxy]ethoxy]ethanol
11-Amino-3,6,9-trioxaundecanol
T4EGMA
Tetraethylene glycol monoamine
2-[2-[2-(2-Hydroxyethoxy)ethoxy]ethoxy]ethylamine
2-(2-(2-(2-Aminoethoxy)ethoxy)ethoxy)ethan-1-ol
Identifiers:
SMILES:
NCCOCCOCCOCCO
InChI:
InChI=1S/C8H19NO4/c9-1-3-11-5-7-13-8-6-12-4-2-10/h10H,1-9H2
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 | 193.24 g/mol | CAS Common Chemistry |
| 193.24299999999997 g/mol | RDKit | |
| 193.131408088 g/mol | RDKit | |
| Canonical SMILES | OCCOCCOCCOCCN | CAS Common Chemistry |
| InChI | InChI=1S/C8H19NO4/c9-1-3-11-5-7-13-8-6-12-4-2-10/h10H,1-9H2 | CAS Common Chemistry |
| InChI Key | InChIKey=ANOJXMUSDYSKET-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-[2-[2-(2-Aminoethoxy)ethoxy]ethoxy]ethanol | CAS Common Chemistry |
| Heavy Atom Count | 13 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 10 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 73.94000000000001 Ų | RDKit |
| LogP | -1.0127999999999988 | RDKit |
| Molar Refractivity | 48.597200000000036 | RDKit |
