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Molecule
Tetraethylthiuram Disulfide
CAS: 97-77-8 · C10H20N2S4
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 97-77-8
- Molecular Formula
- C10H20N2S4
- Molecular Mass
- 296.55 g/mol
Identifiers
CAS Registry Number
97-77-8
SMILES
CCN(CC)C(=S)SSC(=S)N(CC)CC
InChI Key
AUZONCFQVSMFAP-UHFFFAOYSA-N
InChI
InChI=1S/C10H20N2S4/c1-5-11(6-2)9(13)15-16-10(14)12(7-3)8-4/h5-8H2,1-4H3
Names and Synonyms
- Tetraethylthiuram Disulfide Common Name
- Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), N,N,N′,N′-tetraethyl- Synonym
- Akrochem TETD Synonym
- Nocceler TED Synonym
- Tetraethyldithiuram disulfide Synonym
- Etiltox Synonym
- N,N,N′,N′-Tetraethyldithiuram disulfide Synonym
- Curekind TETD Synonym
- Accelerator TET Synonym
- N,N-Diethyl[(diethylcarbamothioyl)disulfanyl]carbothioamide Synonym
- TETDS Synonym
- Rhenogran TETD Synonym
- TETD 80 Synonym
- Curebead PB 75 Synonym
- Disulfide, bis(diethylthiocarbamoyl) Synonym
- Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), tetraethyl- Synonym
- N,N,N′,N′-Tetraethylthioperoxydicarbonic diamide ([(H2N)C(S)]2S2) Synonym
- Abstensil Synonym
- Abstinyl Synonym
- Alcophobin Synonym
- Antabuse Synonym
- Antadix Synonym
- Antaethyl Synonym
- Antalcol Synonym
- Antietanol Synonym
- Antietil Synonym
- Antikol Synonym
- Aversan Synonym
- Bis(N,N-diethylthiocarbamoyl) disulfide Synonym
- Bis(diethylthiocarbamoyl) disulfide Synonym
- Contralin Synonym
- Cronetal Synonym
- Disulfiram Synonym
- Esperal Synonym
- Etabus Synonym
- Ethyl Thiram Synonym
- Ethyl Thiurad Synonym
- Ethyl Tuex Synonym
- Exhorran Synonym
- Noxal Synonym
- Refusal Synonym
- Stopetyl Synonym
- TETD Synonym
- Tetradine Synonym
- Tetraethylthiuram disulfide Synonym
- Tetraetil Synonym
- Thiuram E Synonym
- Thiuranide Synonym
- TTD Synonym
- Antabus Synonym
- N,N,N′,N′-Tetraethylthiuram disulfide Synonym
- Tetraethylthiram disulfide Synonym
- Tetraethylthiuram Synonym
- Teturam Synonym
- Ekagom TEDS Synonym
- Ekagom TETDS Synonym
- Dicupral Synonym
- Averzan Synonym
- Abstinil Synonym
- Antetan Synonym
- Antetil Synonym
- Krotenal Synonym
- Tetradin Synonym
- Espenal Synonym
- Antivitium Synonym
- TTs Synonym
- Hoca Synonym
- Tetraethylthioperoxydicarbonic diamide Synonym
- Anticol Synonym
- Nocceler TET Synonym
- Tetraethylthiuram sulfide Synonym
- Accel TET Synonym
- Ekagom DTET Synonym
- Ethyl Tuads Synonym
- Sanceler TET Synonym
- Teturamin Synonym
- Sanceler TET-G Synonym
- NSC 25953 Synonym
- Soxinol TET Synonym
- Accel TET-R Synonym
- Nocceler TET-G Synonym
- Exhoran Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 296.55 g/mol | CAS Common Chemistry |
| 296.5520000000001 g/mol | RDKit | |
| 296.552 g/mol | RDKit | |
| 296.524 g/mol | chempirical lib | |
| Density | 1.30 g/cm³ | CAS Common Chemistry |
| 1.30 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | S=C(SSC(=S)N(CC)CC)N(CC)CC | CAS Common Chemistry |
| InChI | InChI=1S/C10H20N2S4/c1-5-11(6-2)9(13)15-16-10(14)12(7-3)8-4/h5-8H2,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=AUZONCFQVSMFAP-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 71.5 °C | CAS Common Chemistry |
| Name | Tetraethylthiuram disulfide | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 6.48 Ų | RDKit |
| LogP | 3.6212000000000026 | RDKit |
| 3.6212 | RDKit | |
| Molar Refractivity | 86.22000000000004 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.8 | RDKit |
| Exact Mass | 296.05093264 g/mol | RDKit |
| Boiling Point | 117 °C @ 17 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 296.55 g/mol; density = 1.300 g/mL. Edit any field — others recompute live.
