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Synonyms
AS-58399 | SR-01000423537-1 | Stearic acid-N-hydroxy succinimide ester | 1-amino-5-chloro-2-phenoxybenzene | SCHEMBL307310 | MFCD00025217 | 4-Chloro-2-aminodiphenyl ether | 4-chloro-2-aminodiphenylether | NSC59759 | NSC-59759 | DTXSID70239224 | 2-Amino-4-
Specifications Synonyms
AS-58399 | SR-01000423537-1 | Stearic acid-N-hydroxy succinimide ester | 1-amino-5-chloro-2-phenoxybenzene | SCHEMBL307310 | MFCD00025217 | 4-Chloro-2-aminodiphenyl ether | 4-chloro-2-aminodiphenylether | NSC59759 | NSC-59759 | DTXSID70239224 | 2-Amino-4-
Specifications & Purity
≥97%
Names and Identifiers Pubchem Sid 488183839 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488183839 Canonical Smiles C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N IUPAC Name 5-chloro-2-phenoxyaniline InChIKey SXEBHIMOUHBBOS-UHFFFAOYSA-N INCHI 1S/C12H10ClNO/c13-9-6-7-12(11(14)8-9)15-10-4-2-1-3-5-10/h1-8H,14H2 Isomeric SMILES C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N WGK Germany 2 Molecular Weight 219.67 Beilstein 13(3)843 Reaxy-Rn 2107978 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2107978&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.
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Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass Diphenylethers Intermediate Tree Nodes Not available Direct Parent Diphenylethers Alternative Parents Diarylethers Phenoxy compounds Phenol ethers Aniline and substituted anilines Chlorobenzenes Aryl chlorides Primary amines Organopnictogen compounds Organochlorides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Diphenylether - Diaryl ether - Phenoxy compound - Aniline or substituted anilines - Phenol ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Ether - Amine - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group. 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(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Boil Point(°C) 192 °C/12 mmHg Melt Point(°C) 41-44°C Molecular Weight 219.660 g/mol XLogP3 3.100 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 2 Exact Mass 219.045 Da Monoisotopic Mass 219.045 Da Topological Polar Surface Area 35.300 Ų Heavy Atom Count 15 Formal Charge 0 Complexity 194.000 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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