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Sodium Dibutyldithiocarbamate
CAS: 136-30-1 | C9H19NNaS2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
136-30-1
Molecular Formula:
C9H19NNaS2
Molecular Mass:
228.38 g/mol
Names and Synonyms:
Sodium Dibutyldithiocarbamate
Carbamodithioic acid, N,N-dibutyl-, sodium salt (1:1)
Carbamic acid, dibutyldithio-, sodium salt
Carbamodithioic acid, dibutyl-, sodium salt
Butyl Namate
Dibutyldithiocarbamic acid sodium salt
Pennac SDB
Sodium DBDT
Sodium dibutyldithiocarbamate
Tepidone
Tepidone rubber accelerator
Vulcacure NB
Sodium N,N-dibutyldithiocarbamate
Dibutyl sodium dithiocarbamate
Accel TP
Nocceler TP
Sodium di-n-butyldithiocarbamate
Accelerator TP
SDBC
Identifiers:
SMILES:
CCCCN(CCCC)C(=S)S.[Na]
InChI:
InChI=1S/C9H19NS2.Na/c1-3-5-7-10(9(11)12)8-6-4-2;/h3-8H2,1-2H3,(H,11,12);
Key Properties
Density
1.09 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 | 228.38 g/mol | CAS Common Chemistry |
| 228.382 g/mol | RDKit | |
| 228.08566088799998 g/mol | RDKit | |
| Density | 1.09 g/cm³ | CAS Common Chemistry |
| 1.09 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | [Na].S=C(S)N(CCCC)CCCC | CAS Common Chemistry |
| InChI | InChI=1S/C9H19NS2.Na/c1-3-5-7-10(9(11)12)8-6-4-2;/h3-8H2,1-2H3,(H,11,12); | CAS Common Chemistry |
| InChI Key | InChIKey=DQUKJTRRFYJQAS-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Sodium dibutyldithiocarbamate | CAS Common Chemistry |
| Heavy Atom Count | 13 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 3.24 Ų | RDKit |
| LogP | 2.7225000000000015 | RDKit |
| Molar Refractivity | 68.72700000000003 | RDKit |
