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Maneb
CAS: 12427-38-2 | C4H6MnN2S4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12427-38-2
Molecular Formula:
C4H6MnN2S4
Molecular Mass:
265.31 g/mol
Names and Synonyms:
Maneb
Manganese, [N-[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]-
Manganese, [ethylenebis[dithiocarbamato]]-
Manganese, [[1,2-ethanediylbis[carbamodithioato]](2-)]-
Manganese, [[2-[(dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]-
Carbamodithioic acid, 1,2-ethanediylbis-, manganese complex
[N-[2-[(Dithiocarboxy)amino]ethyl]carbamodithioato(2-)-κS,κS′]manganese
Dithane M 22
Maneb
Manzate
F 10
Manzate D
Polyram M
Nereb
Manesan
Trimangol
Carbamodithioic acid, 1,2-ethanediylbis-, manganese(2+) salt (1:1)
1,2-Ethylenediylbis(carbamodithioato)manganese
Rhodianebe
Trimangol 80
AAmangan
F 10 (pesticide)
Ethylenebis[dithiocarbamic acid] manganous salt
Manganous ethylenebis[dithiocarbamate]
Maneb 80
Nespor
Plantifog 160M
Manex
Agrox flowable
Tritogol M
Agrox N-M
Manebgan
NM Drill Box
ZZ-Maneb Col
Graneor
Saneb M 22
Identifiers:
SMILES:
[Mn+2].[S-]C([S-])=NCCN=C(S)S
InChI:
InChI=1S/C4H8N2S4.Mn/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
192-204 °C (decomp)
CAS Common Chemistry
Density
1.92 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 | 265.31 g/mol | CAS Common Chemistry |
| 265.31199999999995 g/mol | RDKit | |
| 264.879427292 g/mol | RDKit | |
| Density | 1.92 g/cm³ | CAS Common Chemistry |
| 1.92 g/cm3 @ Temp: 25 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Maneb | CAS Common Chemistry |
| Canonical SMILES | S=C([S-])NCCNC1=[S][Mn+2][S-]1 | CAS Common Chemistry |
| InChI | InChI=1S/C4H8N2S4.Mn/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=YKSNLCVSTHTHJA-UHFFFAOYSA-L | CAS Common Chemistry |
| Melting Point | 192-204 °C (decomp) | CAS Common Chemistry |
| Name | Maneb | 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 |
