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224,000+ research products · Triple ISO certified · COA & SDS available for every product · Same-day shipping on in-stock items N-(9,9-dimethyl-7-oxo-8,10-dihydronaphtho[1,2-b]benzofuran-5-yl)-4-methoxybenzenesulfonamide , CAS No.432014-77-2
Synonyms
MLS000530761 | N-(9,9-dimethyl-7-oxo-8,10-dihydronaphtho[1,2-b][1]benzofuran-5-yl)-4-methoxybenzenesulfonamide | N-(9,9-dimethyl-7-oxo-8,10-dihydronaphtho[1,2-b]benzofuran-5-yl)-4-methoxybenzenesulfonamide | N-(9,9-dimethyl-7-oxo-7,8,9,10-tetrahydrobenzo[
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships 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
MLS000530761 | N-(9, 9-dimethyl-7-oxo-8, 10-dihydronaphtho[1, 2-b][1]benzofuran-5-yl)-4-methoxybenzenesulfonamide | N-(9, 9-dimethyl-7-oxo-8, 10-dihydronaphtho[1, 2-b]benzofuran-5-yl)-4-methoxybenzenesulfonamide | N-(9, 9-dimethyl-7-oxo-7, 8, 9, 10-tetrahydrobenzo[
Product Properties Names and Identifiers Canonical Smiles CC1(CC2=C(C(=O)C1)C3=C(O2)C4=CC=CC=C4C(=C3)NS(=O)(=O)C5=CC=C(C=C5)OC)C IUPAC Name N-(9,9-dimethyl-7-oxo-8,10-dihydronaphtho[1,2-b][1]benzofuran-5-yl)-4-methoxybenzenesulfonamide InChIKey VQIHVNJYEXYLGL-UHFFFAOYSA-N INCHI 1S/C25H23NO5S/c1-25(2)13-21(27)23-19-12-20(26-32(28,29)16-10-8-15(30-3)9-11-16)17-6-4-5-7-18(17)24(19)31-22(23)14-25/h4-12,26H,13-14H2,1-3H3 Isomeric SMILES CC1(CC2=C(C(=O)C1)C3=C(O2)C4=CC=CC=C4C(=C3)NS(=O)(=O)C5=CC=C(C=C5)OC)C PubChem CID 1332299 Molecular Weight 449.5
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Naphthofurans Subclass Not available Intermediate Tree Nodes Not available Direct Parent Naphthofurans Alternative Parents Sulfanilides Naphthalenes Benzenesulfonamides Benzofurans Benzenesulfonyl compounds Phenoxy compounds Anisoles Methoxybenzenes Aryl alkyl ketones Alkyl aryl ethers Organosulfonamides Aminosulfonyl compounds Heteroaromatic compounds Furans Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents Naphthofuran - Naphthalene - Sulfanilide - Benzenesulfonamide - Benzofuran - Benzenesulfonyl group - Phenoxy compound - Phenol ether - Anisole - Aryl ketone - Aryl alkyl ketone - Methoxybenzene - Alkyl aryl ether - Benzenoid - Organosulfonic acid amide - Monocyclic benzene moiety - Aminosulfonyl compound - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Furan - Heteroaromatic compound - Ketone - Oxacycle - Ether - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as naphthofurans. These are compounds containing a furan ring fused to a naphthalene moiety. Furan is a 5 membered- ring aromatic ring with four carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings. 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 Molecular Weight 449.500 g/mol XLogP3 5.000 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 4 Exact Mass 449.13 Da Monoisotopic Mass 449.13 Da Topological Polar Surface Area 94.000 Ų Heavy Atom Count 32 Formal Charge 0 Complexity 813.000 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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