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Molecule
Zineb
CAS: 12122-67-7 · C4H6N2S4Zn
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 12122-67-7
- Molecular Formula
- C4H6N2S4Zn
- Molecular Mass
- 275.76 g/mol
Identifiers
CAS Registry Number
12122-67-7
SMILES
[S-]C([S-])=NCCN=C(S)S.[Zn+2]
InChI Key
AMHNZOICSMBGDH-UHFFFAOYSA-L
InChI
InChI=1S/C4H8N2S4.Zn/c7-3(8)5-1-2-6-4(9)10;/h1-2H2,(H2,5,7,8)(H2,6,9,10);/q;+2/p-2
Names and Synonyms
- Zineb Common Name
- Zinc, [N-[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]- Synonym
- Zinc, [ethylenebis[dithiocarbamato]]- Synonym
- Zinc, [[1,2-ethanediylbis[carbamodithioato]](2-)]- Synonym
- Zinc, [[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]- Synonym
- Carbamodithioic acid, 1,2-ethanediylbis-, zinc complex Synonym
- [N-[2-[(Dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]zinc Synonym
- Aspor Synonym
- Blizene Synonym
- Carbadine Synonym
- Dithane Z 78 Synonym
- Lirotan Synonym
- Lonacol Synonym
- Novozir N Synonym
- Parzate zineb Synonym
- Zineb Synonym
- Cynkotox Synonym
- Hexathane Synonym
- Asporum Synonym
- Crittox Synonym
- Micide 55 Synonym
- Zineb 80 Synonym
- Carbamodithioic acid, 1,2-ethanediylbis-, zinc salt Synonym
- Zebenide Synonym
- Dithane Z Synonym
- Novozir N 50 Synonym
- Novozir Synonym
- Daisen Synonym
- Dithane 65 Synonym
- Perozine Synonym
- Perozin Synonym
- Zinc ethylenebis[dithiocarbamate] Synonym
- Discon Synonym
- Perozine 75B Synonym
- Perozin 75B Synonym
- Ethylenebis[dithiocarbamato]zinc Synonym
- Ethylenebis[dithiocarbamic acid] zinc salt Synonym
- Zinc N,N′-ethylenebisdithiocarbamate Synonym
- Aaphytora Synonym
- Aphytora Synonym
- Deikusol Synonym
- Fungo-Pulvit Synonym
- Thionic M Synonym
- Pilzol SZ Synonym
- Unizeb Synonym
- Zinosan Synonym
- Aspor C Synonym
- Funjeb Synonym
- Polyram Z Synonym
- Phytox Synonym
- Dipher Synonym
- Tiezene Synonym
- Zebtox Synonym
- Tritoftorol Synonym
- Curit Synonym
- Turbair Zineb Fungicide Synonym
- Bonzeb 10 Synonym
- Bonzeb Synonym
- Indofil Z 78 Synonym
- Azzurro Synonym
- NSC 49513 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 275.76 g/mol | CAS Common Chemistry |
| 275.76400000000007 g/mol | RDKit | |
| 275.764 g/mol | RDKit | |
| 279.758 g/mol | chempirical lib | |
| Density | 1.74 g/cm³ | CAS Common Chemistry |
| 1.74 g/cm3 (approx) @ 20 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Zineb | CAS Common Chemistry |
| Canonical SMILES | S=C([S-])NCCNC1=[S][Zn+2][S-]1 | CAS Common Chemistry |
| InChI | InChI=1S/C4H8N2S4.Zn/c7-3(8)5-1-2-6-4(9)10;/h1-2H2,(H2,5,7,8)(H2,6,9,10);/q;+2/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=AMHNZOICSMBGDH-UHFFFAOYSA-L | CAS Common Chemistry |
| Melting Point | 157 °C (decomp) | CAS Common Chemistry |
| Name | Zineb | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 24.72 Ų | RDKit |
| LogP | 0.6493 | RDKit |
| Molar Refractivity | 57.30600000000002 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.5 | RDKit |
| Exact Mass | 273.870524392 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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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
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MW = 275.76 g/mol; density = 1.740 g/mL. Edit any field — others recompute live.
