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Molecule
Dimorpholinodiethyl Ether
CAS: 6425-39-4 · C12H24N2O3
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 6425-39-4
- Molecular Formula
- C12H24N2O3
- Molecular Mass
- 244.33 g/mol
Identifiers
CAS Registry Number
6425-39-4
SMILES
C1CN(CCOCCN2CCOCC2)CCO1
InChI Key
ZMSQJSMSLXVTKN-UHFFFAOYSA-N
InChI
InChI=1S/C12H24N2O3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-12H2
Names and Synonyms
- Dimorpholinodiethyl Ether Common Name
- Morpholine, 4,4′-(oxydi-2,1-ethanediyl)bis- Synonym
- Morpholine, 4,4′-(oxydiethylene)di- Synonym
- 4,4′-(Oxydi-2,1-ethanediyl)bis[morpholine] Synonym
- Bis(morpholinoethyl) ether Synonym
- 2,2′-Dimorpholinodiethyl ether Synonym
- β,β′-Dimorpholinodiethyl ether Synonym
- 4,4′-(Oxydiethylene)bis[morpholine] Synonym
- 4,4′-(Oxydiethylene)dimorpholine Synonym
- Dimorpholinodiethyl ether Synonym
- Texacat DMDEE Synonym
- Jeffcat DMDEE Synonym
- Di(2-morpholinoethyl) ether Synonym
- PC CAT DMDEE Synonym
- Bis[2-(4-morpholino)ethyl] ether Synonym
- Dabco DMDEE Synonym
- NSC 28749 Synonym
- U-CAT 660M Synonym
- Bis(2-morpholinoethyl) ether Synonym
- DMDEE Synonym
- 4,4′-(Oxydi-2,1-ethanediyl)bismorpholine Synonym
- Lupragen N 106 Synonym
- N 106 Synonym
- JD-DMDEE Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 244.33 g/mol | CAS Common Chemistry |
| 244.3349999999999 g/mol | RDKit | |
| 244.335 g/mol | RDKit | |
| Density | 1.07 g/cm³ | CAS Common Chemistry |
| 1.0682 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | O(CCN1CCOCC1)CCN2CCOCC2 | CAS Common Chemistry |
| InChI | InChI=1S/C12H24N2O3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-12H2 | CAS Common Chemistry |
| InChI Key | InChIKey=ZMSQJSMSLXVTKN-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Dimorpholinodiethyl ether | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 34.17 Ų | RDKit |
| 33.71 Ų | chempirical lib | |
| LogP | -0.332599999999998 | RDKit |
| -0.3326 | RDKit | |
| Molar Refractivity | 65.33700000000005 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 244.178692628 g/mol | RDKit |
| Boiling Point | 176-182 °C @ 8 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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100
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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.
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MW = 244.33 g/mol; density = 1.070 g/mL. Edit any field — others recompute live.
