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· · COA & SDS available for every product · Same-day shipping on in-stock items [1-Hydroxy-3-(pyridin-3-yl)propane-1,1-diyl]bis(phosphonic acid) , CAS No.104261-69-0
Synonyms
Homorisedronate | NE 58051 | NE-58051 | PLW2TN7B39 | [1-hydroxy-3-(pyridin-3-yl)propane-1,1-diyl]bis(phosphonic acid) | Phosphonic acid, (1-hydroxy-3-(3-pyridinyl)propylidene)bis- | HRX | UNII-PLW2TN7B39 | 3-(3-Pyridyl)-1-hydroxypropylidene bisphosphonic
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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
Homorisedronate | NE 58051 | NE-58051 | PLW2TN7B39 | [1-hydroxy-3-(pyridin-3-yl)propane-1, 1-diyl]bis(phosphonic acid) | Phosphonic acid, (1-hydroxy-3-(3-pyridinyl)propylidene)bis- | HRX | UNII-PLW2TN7B39 | 3-(3-Pyridyl)-1-hydroxypropylidene bisphosphonic
Product Properties Names and Identifiers Canonical Smiles C1=CC(=CN=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O IUPAC Name (1-hydroxy-1-phosphono-3-pyridin-3-ylpropyl)phosphonic acid InChIKey ILROXFQHACCDLA-UHFFFAOYSA-N INCHI 1S/C8H13NO7P2/c10-8(17(11,12)13,18(14,15)16)4-3-7-2-1-5-9-6-7/h1-2,5-6,10H,3-4H2,(H2,11,12,13)(H2,14,15,16) Isomeric SMILES C1=CC(=CN=C1)CCC(O)(P(=O)(O)O)P(=O)(O)O Molecular Weight 297.14 Reaxy-Rn 8153503 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8153503&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 Organic acids and derivatives Class Organic phosphonic acids and derivatives Subclass Bisphosphonates Intermediate Tree Nodes Not available Direct Parent Bisphosphonates Alternative Parents Pyridines and derivatives Organic phosphonic acids Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organophosphorus compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Bisphosphonate - Pyridine - Heteroaromatic compound - Organophosphonic acid - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound Description This compound belongs to the class of organic compounds known as bisphosphonates. These are organic compounds containing two phosphonate groups linked together through a carbon atoms. 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 297.140 g/mol XLogP3 -2.800 Hydrogen Bond Donor Count 5 Hydrogen Bond Acceptor Count 8 Rotatable Bond Count 5 Exact Mass 297.017 Da Monoisotopic Mass 297.017 Da Topological Polar Surface Area 148.000 Ų Heavy Atom Count 18 Formal Charge 0 Complexity 354.000 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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