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Sodium Tartrate
CAS: 868-18-8 | C4H6Na2O6
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
868-18-8
Molecular Formula:
C4H6Na2O6
Molecular Mass:
196.07 g/mol
Names and Synonyms:
Sodium Tartrate
Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, sodium salt (1:2)
Tartaric acid, disodium salt
Butanedioic acid, 2,3-dihydroxy-[R-(R*,R*)]-, disodium salt
Sodium tartrate (Na2(C4H4O6))
Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, disodium salt
Disodium tartrate
Sal tartar
Bisodium tartrate
Disodium L-tartrate
Disodium L-(+)-tartrate
Sodium L-(+)-tartrate
Disodium (+)-tartrate
Sodium tartrate
Disodium d-tartrate
L-Disodium tartrate
Identifiers:
SMILES:
O=C(O)[C@H](O)[C@@H](O)C(=O)O.[Na].[Na]
InChI:
InChI=1S/C4H6O6.2Na/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;/t1-,2-;;/m1../s1
Key Properties
Density
1.82 g/cm³
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 | 196.07 g/mol | CAS Common Chemistry |
| 196.066 g/mol | RDKit | |
| 195.99597647199997 g/mol | RDKit | |
| Density | 1.82 g/cm³ | CAS Common Chemistry |
| 1.82 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Sodium_tartrate | CAS Common Chemistry |
| Canonical SMILES | [Na].O=C(O)C(O)C(O)C(=O)O | CAS Common Chemistry |
| InChI | InChI=1S/C4H6O6.2Na/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;/t1-,2-;;/m1../s1 | CAS Common Chemistry |
| InChI Key | InChIKey=RSGQDAUWSVMQCN-OLXYHTOASA-N | CAS Common Chemistry |
| Name | Sodium tartrate | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 4 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 115.06000000000002 Ų | RDKit |
| LogP | -2.8841999999999994 | RDKit |
| Molar Refractivity | 38.793200000000006 | RDKit |
