Back to Search
Molecule
4-(3-Aminopropyl)Morpholine
CAS: 123-00-2 · C7H16N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 123-00-2
- Molecular Formula
- C7H16N2O
- Molecular Mass
- 144.22 g/mol
Identifiers
CAS Registry Number
123-00-2
SMILES
NCCCN1CCOCC1
InChI Key
UIKUBYKUYUSRSM-UHFFFAOYSA-N
InChI
InChI=1S/C7H16N2O/c8-2-1-3-9-4-6-10-7-5-9/h1-8H2
Names and Synonyms
- 4-(3-Aminopropyl)Morpholine Synonym
- 4-Morpholinepropanamine Synonym
- Morpholine, 4-(3-aminopropyl)- Synonym
- γ-Morpholinopropylamine Synonym
- N-(3-Aminopropyl)morpholine Synonym
- 4-(γ-Aminopropyl)morpholine Synonym
- 1-Amino-3-morpholinopropane Synonym
- 3-Morpholinopropylamine Synonym
- 3-Amino-1-(morpholino)propane Synonym
- 4-(3-Aminopropyl)morpholine Synonym
- 3-(4-Morpholinyl)propylamine Synonym
- 3-(N-Morpholino)-1-aminopropane Synonym
- 3-Morpholinopropanamine Synonym
- 3-(Morpholino)-n-propylamine Synonym
- 3-(4-Morpholinyl)propanamine Synonym
- 3-(4-Morpholinyl)-1-propanamine Synonym
- 1-Morpholino-3-aminopropane Synonym
- NSC 1081 Synonym
- 3-(4-Morpholinyl)-1-propylamine Synonym
- 3-(Morpholin-4-yl)propylamine Synonym
- 3-(4-Morpholino)propylamine Synonym
- [3-(4-Morpholinyl)propan-1-yl]amine Synonym
- [3-(Morpholino)propan-1-yl]amine Synonym
- N-Morpholino-3-propylamine Synonym
- 3-(Morpholin-4-yl)propan-1-amine Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 144.22 g/mol | CAS Common Chemistry |
| 144.21799999999996 g/mol | RDKit | |
| 144.218 g/mol | RDKit | |
| Density | 0.99 g/cm³ | CAS Common Chemistry |
| 0.9902 g/cm3 @ 15 °C | CAS Common Chemistry | |
| Boiling Point | 220 °C | CAS Common Chemistry |
| Canonical SMILES | O1CCN(CC1)CCCN | CAS Common Chemistry |
| InChI | InChI=1S/C7H16N2O/c8-2-1-3-9-4-6-10-7-5-9/h1-8H2 | CAS Common Chemistry |
| InChI Key | InChIKey=UIKUBYKUYUSRSM-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -15 °C | CAS Common Chemistry |
| Name | 4-(3-Aminopropyl)morpholine | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 38.489999999999995 Ų | RDKit |
| 38.49 Ų | RDKit | |
| 38.26 Ų | chempirical lib | |
| LogP | -0.3325999999999998 | RDKit |
| -0.3326 | RDKit | |
| Molar Refractivity | 40.93040000000001 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 144.126263132 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
Convert
Quick conversion
MW = 144.22 g/mol; density = 0.990 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C7H16N2O.
