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Mancozeb
CAS: 8018-01-7 | C8H12MnN4S8Zn
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
8018-01-7
Molecular Formula:
C8H12MnN4S8Zn
Molecular Weight:
541.0760000000002 g/mol
Names and Synonyms:
Mancozeb
Synonym
Manganese, [N-[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]-, mixt. with [N-[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]zinc
Synonym
Manganese, [[1,2-ethanediylbis[carbamodithioato]](2-)]-, mixt. with [[1,2-ethanediylbis[carbamodithioato]](2-)]zinc
Synonym
Carbamic acid, ethylenebis[dithio-, manganese zinc complex
Synonym
Manganese, [[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]-, mixt. with [[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]zinc
Synonym
Carbamodithioic acid, 1,2-ethanediylbis-, zinc complex
Synonym
Carbamodithioic acid, 1,2-ethanediylbis-, manganese complex
Synonym
Zinc, [[1,2-ethanediylbis[carbamodithioato]](2-)]-, mixt. contg.
Synonym
Zinc, [[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]-, mixt. contg.
Synonym
Dithane M 45
Synonym
Mancozeb
Synonym
Manoseb
Synonym
Marzin
Synonym
Zinc manganese ethylenebisdithiocarbamate
Synonym
Dithane ultra
Synonym
F 2966
Synonym
Fore
Synonym
Zimanat
Synonym
Manzate 200
Synonym
Green-daisen M
Synonym
Manzeb
Synonym
Dithane SPC
Synonym
Vondozeb
Synonym
Maneb-zinc
Synonym
Dithane S 60
Synonym
Carmazine
Synonym
Karamate
Synonym
Zimaneb
Synonym
Ziman-Dithane
Synonym
Novozir MN 80
Synonym
Tanzeo M 45
Synonym
Othane M 45
Synonym
Kascade
Synonym
Manzidan
Synonym
Mancozan
Synonym
Milcozebe
Synonym
Tritogol MZ
Synonym
Mancozi
Synonym
Mancomix
Synonym
Dithane F
Synonym
Nemispor
Synonym
Mancosan
Synonym
Agrox 16D
Synonym
Dithane M80
Synonym
Penncozeb
Synonym
Dithane 945
Synonym
Karamate N
Synonym
Thane M 45
Synonym
Novozir MN
Synonym
Dithane DG
Synonym
Pennfluid
Synonym
Sancozeb
Synonym
Liro manzeb
Synonym
Indofil M 45
Synonym
Dithane F 45
Synonym
Dithane
Synonym
Sandozeb Pepite
Synonym
Mankogal
Synonym
Pencozeb
Synonym
Mycotrin
Synonym
Diesen M
Synonym
Sakozeb Blue
Synonym
Dithane DG NT
Synonym
Dithane OS
Synonym
Dithane Rainshield Neo Tec
Synonym
Mancozebe Sipcam
Synonym
Contizeb
Synonym
Suncozeb
Synonym
Dhanuka M 45
Synonym
Dithane Neo Tec 75WG
Synonym
Jimanaisen
Synonym
Jimandaisen
Synonym
Hi-shield
Synonym
Indofil 80WP
Synonym
Trimanoc
Synonym
Daisenmengxin
Synonym
Dithane M45
Synonym
Greenzeb 80WP
Synonym
Indofil M45
Synonym
Agrozeb 80WP
Synonym
Dithane 60SC
Synonym
Banazeb 60SC
Synonym
Dithane NT
Synonym
Mount 45
Synonym
Identifiers:
SMILES:
SC(S)=NCCN=C(S)S.[Mn+2].[S-]C([S-])=NCCN=C([S-])[S-].[Zn+2]
InChI:
InChI=1S/2C4H8N2S4.Mn.Zn/c2*7-3(8)5-1-2-6-4(9)10;;/h2*1-2H2,(H2,5,7,8)(H2,6,9,10);;/q;;2*+2/p-4
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 541.08 g/mol | Legacy Database |
| density | 1.92 g/cm³ | Legacy Database |
| cas-canonical-smile | S=C([S-])NCCNC1=[S][Mn+2][S-]1.S=C([S-])NCCNC1=[S][Zn+2][S-]1 None | Legacy Database |
| cas-density | 1.92 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/2C4H8N2S4.Mn.Zn/c2*7-3(8)5-1-2-6-4(9)10;;/h2*1-2H2,(H2,5,7,8)(H2,6,9,10);;/q;;2*+2/p-4 None | Legacy Database |
| cas-inchi-key | InChIKey=CHNQZRKUZPNOOH-UHFFFAOYSA-J None | Legacy Database |
| cas-melting-point | 192-204 °C (decomp) None | Legacy Database |
| cas-name | Mancozeb None | Legacy Database |
| LogP | 1.2986 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 541.0760000000002 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 538.749951684 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 22 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 8 count | RDKit |
| Hydrogen Bond Donors | 4 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 6 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 49.44 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 114.612 | RDKit |