≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | CN(C)C(=S)SC |
|---|---|
| IUPAC Name | methyl N,N-dimethylcarbamodithioate |
| InChIKey | NBBZMDUHKWRYSZ-UHFFFAOYSA-N |
| INCHI | 1S/C4H9NS2/c1-5(2)4(6)7-3/h1-3H3 |
| Isomeric SMILES | CN(C)C(=S)SC |
| Alternate CAS | 3735-92-0 |
| PubChem CID | 19526 |
| NSC Number | 40176 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic acids and derivatives |
| Class | Dithiocarbamic acids and derivatives |
| Subclass | Dithiocarbamic acid esters |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Dithiocarbamic acid esters |
| Alternative Parents | Sulfenyl compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Dithiocarbamic acid ester - Sulfenyl compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as dithiocarbamic acid esters. These are organosulfur compounds with the general formula R3SC(=S)N(R1)R2; R1-R2 = H or organyl group, R3 = organyl. |
| External Descriptors | Not available |
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| Molecular Weight | 135.300 g/mol |
|---|---|
| XLogP3 | 1.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 135.018 Da |
| Monoisotopic Mass | 135.018 Da |
| Topological Polar Surface Area | 60.600 Ų |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Complexity | 70.100 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
