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· · COA & SDS available for every product · Same-day shipping on in-stock items 3,5-Dimethoxybenzamide - ≥98% , CAS No.17213-58-0
Synonyms
NSC 16615 | EINECS 241-257-0 | 3,5-Dimethoxybenzamide, 97% | DTXSID20169209 | MFCD00007987 | InChI=1/C9H11NO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H2,10,11 | D1558 | A852423 | 3,5-Dimethoxybenzamide | Oprea1_549641 | AKOS000278372 | AM787 | NSC16
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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
NSC 16615 | EINECS 241-257-0 | 3, 5-Dimethoxybenzamide, 97% | DTXSID20169209 | MFCD00007987 | InChI=1/C9H11NO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H, 1-2H3, (H2, 10, 11 | D1558 | A852423 | 3, 5-Dimethoxybenzamide | Oprea1_549641 | AKOS000278372 | AM787 | NSC16
Specifications & Purity
≥98%
Names and Identifiers Pubchem Sid 488184728 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488184728 Canonical Smiles COC1=CC(=CC(=C1)C(=O)N)OC IUPAC Name 3,5-dimethoxybenzamide InChIKey YTLRWVNYANKXOW-UHFFFAOYSA-N INCHI 1S/C9H11NO3/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H2,10,11) Isomeric SMILES COC1=CC(=CC(=C1)C(=O)N)OC WGK Germany 3 Molecular Weight 181.19 Beilstein 2641361 Reaxy-Rn 2641361 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2641361&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 Class Benzene and substituted derivatives Subclass Methoxybenzenes Intermediate Tree Nodes Not available Direct Parent Dimethoxybenzenes Alternative Parents Benzamides Phenoxy compounds Benzoyl derivatives Anisoles Alkyl aryl ethers Primary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents M-dimethoxybenzene - Dimethoxybenzene - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Primary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups. 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) 147 °C Molecular Weight 181.190 g/mol XLogP3 1.500 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 3 Exact Mass 181.074 Da Monoisotopic Mass 181.074 Da Topological Polar Surface Area 61.600 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 172.000 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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