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Molecule
4-Morpholineethanamine
CAS: 2038-03-1 · C6H14N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 2038-03-1
- Molecular Formula
- C6H14N2O
- Molecular Mass
- 130.19 g/mol
Identifiers
CAS Registry Number
2038-03-1
SMILES
NCCN1CCOCC1
InChI Key
RWIVICVCHVMHMU-UHFFFAOYSA-N
InChI
InChI=1S/C6H14N2O/c7-1-2-8-3-5-9-6-4-8/h1-7H2
Names and Synonyms
- 4-Morpholineethanamine Synonym
- 4-Morpholineethanamine Synonym
- Morpholine, 4-(2-aminoethyl)- Synonym
- N-(2-Aminoethyl)morpholine Synonym
- 1-Amino-2-morpholinoethane Synonym
- 2-Morpholinoethylamine Synonym
- β-Morpholinoethylamine Synonym
- N-(β-Aminoethyl)morpholine Synonym
- 2-Morpholinoethanamine Synonym
- 2-(4-Morpholinyl)ethylamine Synonym
- 4-(2-Aminoethyl)morpholine Synonym
- 2-Morpholino-1-ethanamine Synonym
- 2-(4-Morpholinyl)ethanamine Synonym
- 2-(4-Morpholino)ethylamine Synonym
- 4-Aminoethylmorpholine Synonym
- [2-(Morpholin-4-yl)ethyl]amine Synonym
- 2-(Morpholin-4-yl)ethan-1-amine Synonym
- 2-(Morpholin-4-yl)ethanamine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 130.19 g/mol | CAS Common Chemistry |
| 130.19099999999997 g/mol | RDKit | |
| 130.191 g/mol | RDKit | |
| Density | 0.99 g/cm³ | CAS Common Chemistry |
| 0.992 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 205 °C | CAS Common Chemistry |
| Canonical SMILES | O1CCN(CC1)CCN | CAS Common Chemistry |
| InChI | InChI=1S/C6H14N2O/c7-1-2-8-3-5-9-6-4-8/h1-7H2 | CAS Common Chemistry |
| InChI Key | InChIKey=RWIVICVCHVMHMU-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 25.6 °C | CAS Common Chemistry |
| Name | 4-Morpholineethanamine | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 38.489999999999995 Ų | RDKit |
| 38.49 Ų | RDKit | |
| 38.26 Ų | chempirical lib | |
| LogP | -0.7227000000000003 | RDKit |
| -0.7227 | RDKit | |
| Molar Refractivity | 36.3134 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 130.110613068 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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Quick conversion
MW = 130.19 g/mol; density = 0.990 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C6H14N2O.
