| Pubchem Sid | 488194222 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488194222 |
| Sonrisas canónicas | CNC(=C[N+](=O)[O-])SC |
| IUPAC Name | (E)-N-methyl-1-methylsulfanyl-2-nitroethenamine |
| InChIKey | YQFHPXZGXNYYLD-ONEGZZNKSA-N |
| INCHI | 1S/C4H8N2O2S/c1-5-4(9-2)3-6(7)8/h3,5H,1-2H3/b4-3+ |
| Isómeros SMILES | CN/C(=C\[N+](=O)[O-])/SC |
| WGK Alemania | 3 |
| Número ONU | 3335 |
| Peso molecular | 148.18 |
| Reaxy-Rn | 1929912 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1929912&ln= |
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 1,3-dipolar compounds |
| Clase | Allyl-type 1,3-dipolar organic compounds |
| Subclass | Organic nitro compounds |
| Intermediate Tree Nodes | Not available |
| Direct Parent | C-nitro compounds |
| Alternative Parents | Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Dialkylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Secondary amine - Organic oxoazanium - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Amine - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as c-nitro compounds. These are compounds having the nitro group, -NO2 (free valence on nitrogen), which is attached to carbon. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 G1508037 | Certificate of Analysis | Jun 11, 2026 | M110254 |
| C2202442 | Certificate of Analysis | Sep 04, 2025 | M110254 |
| C2202450 | Certificate of Analysis | Sep 04, 2025 | M110254 |
| C2202441 | Certificate of Analysis | Dec 15, 2023 | M110254 |
| D2319407 | Certificate of Analysis | Dec 13, 2022 | M110254 |
| D2319406 | Certificate of Analysis | Mar 07, 2022 | M110254 |
| Sensibilidad | Light Sensitive,Air Sensitive |
|---|---|
| Punto de fusión (°C) | 112-118°C |
| Peso molecular | 148.190 g/mol |
| XLogP3 | 1.000 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 148.031 Da |
| Monoisotopic Mass | 148.031 Da |
| Topological Polar Surface Area | 83.200 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 129.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 1 |
| Covalently-Bonded Unit Count | 1 |
