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Sodium Dimethyldithiocarbamate
CAS: 128-04-1 | C3H7NNaS2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
128-04-1
Molecular Formula:
C3H7NNaS2
Molecular Weight:
144.22 g/mol
Names and Synonyms:
Sodium Dimethyldithiocarbamate
Carbamodithioic acid, N,N-dimethyl-, sodium salt (1:1)
Carbamic acid, dimethyldithio-, sodium salt
Carbamodithioic acid, dimethyl-, sodium salt
Aceto SDD 40
Alcobam NM
Methyl Namate
SDDC
Sodium dimethyldithiocarbamate
Thiostop N
Vulnopol NM
Wing Stop B
Sharstop 204
Sodium N,N-dimethyldithiocarbamate
Dimethyldithiocarbamic acid sodium salt
N,N-Dimethyldithiocarbamic acid sodium salt
Sodium dimethylaminocarbodithioate
MSL
Nocceler S
DDC
Sanceler S
Carbam S
Sodam
Dibam
Vinditat
Sodium dimethylaminodithiocarbamate
Amersep MP 3R
(Dimethyldithiocarbamato)sodium
Midfloc 1300L
MSL (carbamate)
Diaprosim AB 13
Diram
MetalPlex 143
Nalmet A 1
Nocceler S 35
Sanceler S 40
SDD
SDD (polymerization inhibitor)
Sodium N,N-dimethylcarbamodithioate
Preventol Z-L
Sodium 2-(dimethylamino)-2-thioxoethanethiolate
SMC
Identifiers:
SMILES:
CN(C)C(=S)S.[Na]
InChI:
InChI=1S/C3H7NS2.Na/c1-4(2)3(5)6;/h1-2H3,(H,5,6);
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 | 144.22 g/mol | Legacy Database |
| density | 1.18 g/cm³ | Legacy Database |
| cas-canonical-smile | [Na].S=C(S)N(C)C None | Legacy Database |
| cas-density | 1.18 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/C3H7NS2.Na/c1-4(2)3(5)6;/h1-2H3,(H,5,6); None | Legacy Database |
| cas-inchi-key | InChIKey=MJXOOPBZYCWYIF-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 106-108 °C None | Legacy Database |
| cas-name | Sodium dimethyldithiocarbamate None | Legacy Database |
| LogP | 0.38189999999999996 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 144.22 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 143.99176050399998 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 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 | 3.24 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 41.02500000000002 | RDKit |
