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· · COA & SDS available for every product · Same-day shipping on in-stock items 1,1-Bis(methylthio)-2-nitroethylene - ≥98% , CAS No.13623-94-4
Synonyms
(2-nitroethene-1,1-diyl)bis(methylsulfane) | 1-nitro-2,2-bis(methylthio)ethene | AKOS000281014 | EN300-43557 | Ethene, 1,1-bis(methylthio)-2-nitro- | 1-nitro-2,2-bis (methylthio)ethylene | Q-200051 | NSC50723 | 1-nitro-2-,2-bis-methylthioethylene | 1-nitr
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Why this grade ≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
(2-nitroethene-1, 1-diyl)bis(methylsulfane) | 1-nitro-2, 2-bis(methylthio)ethene | AKOS000281014 | EN300-43557 | Ethene, 1, 1-bis(methylthio)-2-nitro- | 1-nitro-2, 2-bis (methylthio)ethylene | Q-200051 | NSC50723 | 1-nitro-2-, 2-bis-methylthioethylene | 1-nitr
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 508806918 Canonical Smiles CSC(=C[N+](=O)[O-])SC IUPAC Name 1,1-bis(methylsulfanyl)-2-nitroethene InChIKey NXGHEDHQXXXTTP-UHFFFAOYSA-N INCHI 1S/C4H7NO2S2/c1-8-4(9-2)3-5(6)7/h3H,1-2H3 Isomeric SMILES CSC(=C[N+](=O)[O-])SC WGK Germany 3 Molecular Weight 165.23 Beilstein 1524538 Reaxy-Rn 742167 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742167&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organic 1,3-dipolar compounds Class 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 Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aliphatic acyclic compounds Substituents C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aliphatic acyclic compound Description 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 Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 125-127°C Molecular Weight 165.200 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 2 Exact Mass 164.992 Da Monoisotopic Mass 164.992 Da Topological Polar Surface Area 96.400 Ų Heavy Atom Count 9 Formal Charge 0 Complexity 123.000 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
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