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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 2,4-Dichlorophenyl Isothiocyanate - ≥98%(GC) , CAS No.6590-96-1
Synonyms
(3-Chloro-propyl)-methyl-carbamicacidtert-butylester | D4912 | DTXSID30216117 | Benzene, 2,4-dichloro-1-isothiocyanato- | 2,4-Dichlorophenyl isothiocyanate, 95% | FT-0762152 | AKOS002680234 | SCHEMBL1021797 | 2,4-Dichlorophenyl isothiocyanate | 2,4-Dichlo
Storage
Argon charged,Room temperature
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Why this grade ≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Argon charged,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 Sinónimos
(3-Chloro-propyl)-methyl-carbamicacidtert-butylester | D4912 | DTXSID30216117 | Benzene, 2, 4-dichloro-1-isothiocyanato- | 2, 4-Dichlorophenyl isothiocyanate, 95% | FT-0762152 | AKOS002680234 | SCHEMBL1021797 | 2, 4-Dichlorophenyl isothiocyanate | 2, 4-Dichlo
Especificaciones y pureza
≥98%(GC)
Condiciones de almacenamiento de almacenamiento
Argon charged, Room temperature
Nombres e identificadores Sonrisas canónicas C1=CC(=C(C=C1Cl)Cl)N=C=S IUPAC Name 2,4-dichloro-1-isothiocyanatobenzene InChIKey WVBNZZHGECFCSH-UHFFFAOYSA-N INCHI 1S/C7H3Cl2NS/c8-5-1-2-7(10-4-11)6(9)3-5/h1-3H Isómeros SMILES C1=CC(=C(C=C1Cl)Cl)N=C=S Peso molecular 204.07 Reaxy-Rn 777072 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=777072&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 Benzenoids Clase Benzene and substituted derivatives Subclass Halobenzenes Intermediate Tree Nodes Chlorobenzenes Direct Parent Dichlorobenzenes Alternative Parents Aryl chlorides Isothiocyanates Propargyl-type 1,3-dipolar organic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents 1,3-dichlorobenzene - Aryl halide - Aryl chloride - Isothiocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it. 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad Soluble in Methanol Sensibilidad Moisture sensitive Punto de fusión (°C) 42 °C Peso molecular 204.080 g/mol XLogP3 4.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 202.936 Da Monoisotopic Mass 202.936 Da Topological Polar Surface Area 44.500 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 179.000 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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