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Ethylenediamine Dihydroiodide
CAS: 5700-49-2 | C2H10I2N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
5700-49-2
Molecular Formula:
C2H10I2N2
Molecular Mass:
315.92 g/mol
Names and Synonyms:
Ethylenediamine Dihydroiodide
1,2-Ethanediamine, hydriodide (1:2)
Ethylenediamine, dihydriodide
1,2-Ethanediamine, dihydriodide
Hoffman Bonded E-D-D Iodine Compound
Hydriodide-Boot
Hy-Odide
Iod-Ethamine
Ethylenediamine dihydroiodide
Hydrodine
Hi-O-Dide
EDDI
Jodethamine
1,2-Diammoniumethane diiodide
EDAI2
Identifiers:
SMILES:
I.I.NCCN
InChI:
InChI=1S/C2H8N2.2HI/c3-1-2-4;;/h1-4H2;2*1H
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 | 315.92 g/mol | CAS Common Chemistry |
| 315.9240000000001 g/mol | RDKit | |
| 315.89334432000004 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Ethylenediamine_dihydroiodide | CAS Common Chemistry |
| Canonical SMILES | I.NCCN | CAS Common Chemistry |
| InChI | InChI=1S/C2H8N2.2HI/c3-1-2-4;;/h1-4H2;2*1H | CAS Common Chemistry |
| InChI Key | InChIKey=IWNWLPUNKAYUAW-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Ethylenediamine dihydroiodide | CAS Common Chemistry |
| Heavy Atom Count | 6 | 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 | 0.13980000000000004 | RDKit |
| Molar Refractivity | 48.93880000000001 | RDKit |
