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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
Names and Synonyms:
4-Morpholineethanamine
4-Morpholineethanamine
Morpholine, 4-(2-aminoethyl)-
N-(2-Aminoethyl)morpholine
1-Amino-2-morpholinoethane
2-Morpholinoethylamine
β-Morpholinoethylamine
N-(β-Aminoethyl)morpholine
2-Morpholinoethanamine
2-(4-Morpholinyl)ethylamine
4-(2-Aminoethyl)morpholine
2-Morpholino-1-ethanamine
2-(4-Morpholinyl)ethanamine
2-(4-Morpholino)ethylamine
4-Aminoethylmorpholine
[2-(Morpholin-4-yl)ethyl]amine
2-(Morpholin-4-yl)ethan-1-amine
2-(Morpholin-4-yl)ethanamine
Identifiers:
SMILES:
NCCN1CCOCC1
InChI:
InChI=1S/C6H14N2O/c7-1-2-8-3-5-9-6-4-8/h1-7H2
Key Properties
Boiling Point
205 °C
CAS Common Chemistry
Melting Point
25.6 °C
CAS Common Chemistry
Density
0.99 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 | 130.19 g/mol | CAS Common Chemistry |
| 130.19099999999997 g/mol | RDKit | |
| 130.110613068 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 |
| LogP | -0.7227000000000003 | RDKit |
| Molar Refractivity | 36.3134 | RDKit |
