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Trisodium Edta
CAS: 150-38-9 | C10H16N2Na3O8
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
150-38-9
Molecular Formula:
C10H16N2Na3O8
Molecular Mass:
361.21 g/mol
Names and Synonyms:
Trisodium Edta
Glycine, N,N′-1,2-ethanediylbis[N-(carboxymethyl)-, sodium salt (1:3)
Acetic acid, (ethylenedinitrilo)tetra-, trisodium salt
Glycine, N,N′-1,2-ethanediylbis[N-(carboxymethyl)-, trisodium salt
EDTA trisodium salt
Perma Kleer 50, trisodium salt
Sequestrene trisodium
Sequestrene trisodium salt
Trilon AO
Trisodium edetate
Trisodium hydrogen ethylenediaminetetraacetate
Trisodium hydrogen (ethylenedinitrilo)tetraacetate
Trisodium versenate
Versene 9
Ethylenediaminetetraacetic acid trisodium salt
Nevanaid-B powder
Trisodium ethylenediaminetetraacetate
Sequestrene Na3
Edetate trisodium
Trisodium EDTA
Clewat 300A
Trisodium ETDA
Chelest C
Limclair
Sequestrene NA 3T
EDTA-3Na
Chelest 2CS
Chelate C
Zonon T
Chelest 2C-SD
Clewat 3Na
EDTA trisodium
Identifiers:
SMILES:
O=C(O)CN(CCN(CC(=O)O)CC(=O)O)CC(=O)O.[Na].[Na].[Na]
InChI:
InChI=1S/C10H16N2O8.3Na/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;;
Key Properties
Melting Point
>300 °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 | 361.21 g/mol | CAS Common Chemistry |
| 361.21400000000006 g/mol | RDKit | |
| 361.059973312 g/mol | RDKit | |
| Canonical SMILES | [Na].O=C(O)CN(CC(=O)O)CCN(CC(=O)O)CC(=O)O | CAS Common Chemistry |
| InChI | InChI=1S/C10H16N2O8.3Na/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;; | CAS Common Chemistry |
| InChI Key | InChIKey=BTKOPDXMVKYSNL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | >300 °C | CAS Common Chemistry |
| Name | Trisodium EDTA | CAS Common Chemistry |
| Heavy Atom Count | 23 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 11 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 155.68 Ų | RDKit |
| LogP | -3.213599999999995 | RDKit |
| Molar Refractivity | 80.68520000000002 | RDKit |
