Back to Search
Molecule
Ethylenediamine
CAS: 107-15-3 · C2H8N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 107-15-3
- Molecular Formula
- C2H8N2
- Molecular Mass
- 60.10 g/mol
Identifiers
CAS Registry Number
107-15-3
SMILES
NCCN
InChI Key
PIICEJLVQHRZGT-UHFFFAOYSA-N
InChI
InChI=1S/C2H8N2/c3-1-2-4/h1-4H2
Names and Synonyms
- Ethylenediamine Common Name
- 1,2-Ethanediamine Synonym
- Ethylenediamine Synonym
- 1,2-Diaminoethane Synonym
- Dimethylenediamine Synonym
- 1,2-Ethylenediamine Synonym
- β-Aminoethylamine Synonym
- 1,4-Diazabutane Synonym
- Edamine Synonym
- α,ω-Ethanediamine Synonym
- (2-Aminoethyl)amine Synonym
- LR 500G Synonym
- PB 05721 Synonym
- EDA Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 60.10 g/mol | CAS Common Chemistry |
| 60.09999999999999 g/mol | RDKit | |
| 60.1 g/mol | RDKit | |
| Density | 0.90 g/cm³ | CAS Common Chemistry |
| 0.898 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Ethylenediamine | CAS Common Chemistry |
| Boiling Point | 116-117 °C | CAS Common Chemistry |
| Canonical SMILES | NCCN | CAS Common Chemistry |
| InChI | InChI=1S/C2H8N2/c3-1-2-4/h1-4H2 | CAS Common Chemistry |
| InChI Key | InChIKey=PIICEJLVQHRZGT-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 8.5 °C | CAS Common Chemistry |
| Name | Ethylenediamine | CAS Common Chemistry |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 52.04 Ų | RDKit |
| LogP | -1.0962 | RDKit |
| Molar Refractivity | 18.108800000000006 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 60.06874825599999 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 = 60.10 g/mol; density = 0.900 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C2H8N2.
