Back to Search
4,7,10-Trioxatridecane-1,13-Diamine
CAS: 4246-51-9 | C10H24N2O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4246-51-9
Molecular Formula:
C10H24N2O3
Molecular Mass:
220.31 g/mol
Names and Synonyms:
4,7,10-Trioxatridecane-1,13-Diamine
1-Propanamine, 3,3′-[oxybis(2,1-ethanediyloxy)]bis-
Propylamine, 3,3′-[oxybis(ethyleneoxy)]bis-
3,3′-[Oxybis(2,1-ethanediyloxy)]bis[1-propanamine]
Diethylene glycol bis(3-aminopropyl) ether
4,7,10-Trioxatridecane-1,13-diamine
1,13-Diamino-4,7,10-trioxatridecane
Q 19262
4,7,10-Trioxa-1,13-tridecanamine
Bis[2-(3-aminopropoxy)ethyl] ether
DPA-DEG
Ancamine 1922
O,O′-Bis(3-aminopropyl)diethylene glycol
3,3′-[Oxybis(ethane-2,1-diyloxy)]dipropan-1-amine
Ancamine 1922A
3,3′-((Oxybis(ethane-2,1-diyl))bis(oxy))bis(propan-1-amine)
3-[2-[2-(3-Aminopropoxy)ethoxy]ethoxy]propan-1-amine
TTD
4,7,10-Trioxa-1,1,3-tridecanediamine
Identifiers:
SMILES:
NCCCOCCOCCOCCCN
InChI:
InChI=1S/C10H24N2O3/c11-3-1-5-13-7-9-15-10-8-14-6-2-4-12/h1-12H2
Key Properties
Boiling Point
108-115 °C @ Press: 4 Torr
CAS Common Chemistry
Density
1.01 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 | 220.31 g/mol | CAS Common Chemistry |
| 220.31299999999993 g/mol | RDKit | |
| 220.178692628 g/mol | RDKit | |
| Density | 1.01 g/cm³ | CAS Common Chemistry |
| 1.0110 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Boiling Point | 108-115 °C @ Press: 4 Torr | CAS Common Chemistry |
| Canonical SMILES | O(CCOCCCN)CCOCCCN | CAS Common Chemistry |
| InChI | InChI=1S/C10H24N2O3/c11-3-1-5-13-7-9-15-10-8-14-6-2-4-12/h1-12H2 | CAS Common Chemistry |
| InChI Key | InChIKey=JCEZOHLWDIONSP-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 4,7,10-Trioxatridecane-1,13-diamine | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 12 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 79.73 Ų | RDKit |
| LogP | -0.2661999999999983 | RDKit |
| Molar Refractivity | 59.79980000000004 | RDKit |
