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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-Phenoxymethyl-benzoic acid - ≥95% , CAS No.31719-76-3
Synonyms
10P-369S | 4-Phenoxymethylbenzoic Acid | MFCD00623268 | GRBUVHSYBRTCIB-UHFFFAOYSA-N | HMS1783E05 | 4-(phenoxymethyl)benzoic acid | 4-(Phenoxymethyl)-benzoic acid | BDBM50508821 | Oprea1_842399 | 4-(phenoxymethyl)benzoicacid | CHEBI:195062 | Z54581272 | AK
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Why this grade ≥95% 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
10P-369S | 4-Phenoxymethylbenzoic Acid | MFCD00623268 | GRBUVHSYBRTCIB-UHFFFAOYSA-N | HMS1783E05 | 4-(phenoxymethyl)benzoic acid | 4-(Phenoxymethyl)-benzoic acid | BDBM50508821 | Oprea1_842399 | 4-(phenoxymethyl)benzoicacid | CHEBI:195062 | Z54581272 | AK
Specifications & Purity
≥95%
Names and Identifiers Canonical Smiles C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)O IUPAC Name 4-(phenoxymethyl)benzoic acid InChIKey GRBUVHSYBRTCIB-UHFFFAOYSA-N INCHI 1S/C14H12O3/c15-14(16)12-8-6-11(7-9-12)10-17-13-4-2-1-3-5-13/h1-9H,10H2,(H,15,16) Isomeric SMILES C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)O PubChem CID 737267 Molecular Weight 228.25
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 Benzoic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Benzoic acids Alternative Parents Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Benzoic acid - Phenoxy compound - Phenol ether - Benzoyl - Alkyl aryl ether - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as benzoic acids. These are organic Compounds containing a benzene ring which bears at least one carboxyl 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) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 223-226° Molecular Weight 228.240 g/mol XLogP3 3.300 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 4 Exact Mass 228.079 Da Monoisotopic Mass 228.079 Da Topological Polar Surface Area 46.500 Ų Heavy Atom Count 17 Formal Charge 0 Complexity 238.000 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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