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4-Morpholinamine
CAS: 4319-49-7 | C4H10N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4319-49-7
Molecular Formula:
C4H10N2O
Molecular Mass:
102.14 g/mol
Names and Synonyms:
4-Morpholinamine
4-Morpholinamine
Morpholine, 4-amino-
N-Aminomorpholine
4-Aminomorpholine
4-Morpholineamine
NSC 6825
(Morpholin-4-yl)amine
Identifiers:
SMILES:
NN1CCOCC1
InChI:
InChI=1S/C4H10N2O/c5-6-1-3-7-4-2-6/h1-5H2
Key Properties
Boiling Point
166 °C
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 | 102.14 g/mol | CAS Common Chemistry |
| 102.137 g/mol | RDKit | |
| 102.07931294 g/mol | RDKit | |
| Boiling Point | 166 °C | CAS Common Chemistry |
| Canonical SMILES | O1CCN(N)CC1 | CAS Common Chemistry |
| InChI | InChI=1S/C4H10N2O/c5-6-1-3-7-4-2-6/h1-5H2 | CAS Common Chemistry |
| InChI Key | InChIKey=MKQLBNJQQZRQJU-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 4-Morpholinamine | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 38.489999999999995 Ų | RDKit |
| LogP | -0.8077000000000001 | RDKit |
| Molar Refractivity | 26.579399999999993 | RDKit |
