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· · COA & SDS available for every product · Same-day shipping on in-stock items Diphenyliodonium-2-carboxylate Monohydrate - ≥98% , CAS No.96195-89-0
Synonyms
(2-Carboxyphenyl)phenyliodonium hydrate (1:1) | J-008521 | 2-(Phenyliodonio)benzoate hydrate | AKOS024336446 | MFCD00150328 | SCHEMBL1158182 | AC8604 | NHCFFVMWVHFFSJ-UHFFFAOYSA-N | SY022096 | AC-33670 | s10548 | 2-phenyliodoniobenzoate;hydrate | diphenyl
Storage
Argon charged,Room temperature
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Why this grade ≥98% 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 Synonyms
(2-Carboxyphenyl)phenyliodonium hydrate (1:1) | J-008521 | 2-(Phenyliodonio)benzoate hydrate | AKOS024336446 | MFCD00150328 | SCHEMBL1158182 | AC8604 | NHCFFVMWVHFFSJ-UHFFFAOYSA-N | SY022096 | AC-33670 | s10548 | 2-phenyliodoniobenzoate;hydrate | diphenyl
Specifications & Purity
≥98%
Storage
Argon charged, Room temperature
Names and Identifiers Canonical Smiles C1=CC=C(C=C1)[I+]C2=CC=CC=C2C(=O)[O-].O IUPAC Name 2-phenyliodoniobenzoate;hydrate InChIKey NHCFFVMWVHFFSJ-UHFFFAOYSA-N INCHI 1S/C13H9IO2.H2O/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10;/h1-9H;1H2 Isomeric SMILES C1=CC=C(C=C1)[I+]C2=CC=CC=C2C(=O)[O-].O PubChem CID 22271963 Molecular Weight 342.14 Reaxy-Rn 3550614
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 Halobenzoic acids and derivatives Direct Parent Halobenzoic acids Alternative Parents 2-halobenzoic acids Benzoic acids Benzoyl derivatives 1-carboxy-2-haloaromatic compounds Iodobenzenes Halogenated fatty acids Branched fatty acids Unsaturated fatty acids Carboxylic acid salts Vinyl iodides Monocarboxylic acids and derivatives Organooxygen compounds Organoiodides Organic salts Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Halobenzoic acid - 2-halobenzoic acid - 2-halobenzoic acid or derivatives - Benzoic acid - 1-carboxy-2-haloaromatic compound - Benzoyl - Iodobenzene - Halogenated fatty acid - Halobenzene - Branched fatty acid - Fatty acyl - Fatty acid - Unsaturated fatty acid - Carboxylic acid salt - Vinyl iodide - Vinyl halide - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organoiodide - Organohalogen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as halobenzoic acids. These are benzoic acids carrying a halogen atom on the benzene ring. 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 Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Soluble in Methanol Molecular Weight 342.130 g/mol XLogP3 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 2 Exact Mass 341.975 Da Monoisotopic Mass 341.975 Da Topological Polar Surface Area 41.100 Ų Heavy Atom Count 17 Formal Charge 0 Complexity 231.000 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 2
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