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Zinc Acetate Dihydrate
CAS: 5970-45-6 | C2H6O3Zn
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
5970-45-6
Molecular Formula:
C2H6O3Zn
Molecular Weight:
143.457 g/mol
Names and Synonyms:
Zinc Acetate Dihydrate
Acetic acid, zinc salt, hydrate (2:1:2)
Acetic acid, zinc salt, dihydrate
Zinc acetate dihydrate
Zinc diacetate dihydrate
Wilzin
Identifiers:
SMILES:
CC(=O)O.O.[Zn]
InChI:
InChI=1S/C2H4O2.H2O.Zn/c1-2(3)4;;/h1H3,(H,3,4);1H2;
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 |
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200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
Shift (ppm) | DEPT | Assignment |
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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
Molecular
Property | Value | Source |
---|---|---|
Molecular Weight | 143.457 g/mol | RDKit |
Exact
Property | Value | Source |
---|---|---|
Exact Molecular Weight | 141.960836252 g/mol | RDKit |
Heavy
Property | Value | Source |
---|---|---|
Heavy Atom Count | 6 count | RDKit |
Hydrogen
Property | Value | Source |
---|---|---|
Hydrogen Bond Acceptors | 1 count | RDKit |
Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
Property | Value | Source |
---|---|---|
Rotatable Bonds | 0 count | RDKit |
Aromatic
Property | Value | Source |
---|---|---|
Aromatic Ring Count | 0 count | RDKit |
Topological
Property | Value | Source |
---|---|---|
Topological Polar Surface Area | 68.8 Ų | RDKit |
Physical Properties
Property | Value | Source |
---|---|---|
LogP | -0.7363 | RDKit |
molecular_mass | 143.46 g/mol | Legacy Database |
cas-canonical-smile | [Zn].O=C(O)C.O None | Legacy Database |
cas-inchi | InChI=1S/C2H4O2.H2O.Zn/c1-2(3)4;;/h1H3,(H,3,4);1H2; None | Legacy Database |
cas-inchi-key | InChIKey=AJBKKRFPIWOFAE-UHFFFAOYSA-N None | Legacy Database |
cas-name | Zinc acetate dihydrate None | Legacy Database |
Molar
Property | Value | Source |
---|---|---|
Molar Refractivity | 16.9236 | RDKit |