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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
Names and Synonyms:
Zineb
Zinc, [N-[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]-
Zinc, [ethylenebis[dithiocarbamato]]-
Zinc, [[1,2-ethanediylbis[carbamodithioato]](2-)]-
Zinc, [[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]-
Carbamodithioic acid, 1,2-ethanediylbis-, zinc complex
[N-[2-[(Dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]zinc
Aspor
Blizene
Carbadine
Dithane Z 78
Lirotan
Lonacol
Novozir N
Parzate zineb
Zineb
Cynkotox
Hexathane
Asporum
Crittox
Micide 55
Zineb 80
Carbamodithioic acid, 1,2-ethanediylbis-, zinc salt
Zebenide
Dithane Z
Novozir N 50
Novozir
Daisen
Dithane 65
Perozine
Perozin
Zinc ethylenebis[dithiocarbamate]
Discon
Perozine 75B
Perozin 75B
Ethylenebis[dithiocarbamato]zinc
Ethylenebis[dithiocarbamic acid] zinc salt
Zinc N,N′-ethylenebisdithiocarbamate
Aaphytora
Aphytora
Deikusol
Fungo-Pulvit
Thionic M
Pilzol SZ
Unizeb
Zinosan
Aspor C
Funjeb
Polyram Z
Phytox
Dipher
Tiezene
Zebtox
Tritoftorol
Curit
Turbair Zineb Fungicide
Bonzeb 10
Bonzeb
Indofil Z 78
Azzurro
NSC 49513
Identifiers:
SMILES:
[S-]C([S-])=NCCN=C(S)S.[Zn+2]
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
Key Properties
Melting Point
157 °C (decomp)
CAS Common Chemistry
Density
1.74 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 | 275.76 g/mol | CAS Common Chemistry |
| 275.76400000000007 g/mol | RDKit | |
| 273.870524392 g/mol | RDKit | |
| Density | 1.74 g/cm³ | CAS Common Chemistry |
| 1.74 g/cm3 (approx) @ Temp: 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 | RDKit |
