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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 1,1-Cyclobutanedicarboxylic acid - ≥99% , CAS No.5445-51-2
Synonyms
1,1-Cyclobutanedicarboxylic acid | Cyclobutanedicarboxylic acid | Cyclobutane-1,1-dicarboxylic acid | 1,1-dicarboxylcyclobutane | 1,1-Cyclobutyl dicarboxylic acid
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Why this grade ≥99% 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Sinónimos
1, 1-Cyclobutanedicarboxylic acid | Cyclobutanedicarboxylic acid | Cyclobutane-1, 1-dicarboxylic acid | 1, 1-dicarboxylcyclobutane | 1, 1-Cyclobutyl dicarboxylic acid
Especificaciones y pureza
≥99%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas C1CC(C1)(C(=O)O)C(=O)O IUPAC Name cyclobutane-1,1-dicarboxylic acid InChIKey CCQPAEQGAVNNIA-UHFFFAOYSA-N INCHI 1S/C6H8O4/c7-4(8)6(5(9)10)2-1-3-6/h1-3H2,(H,7,8)(H,9,10) Isómeros SMILES C1CC(C1)(C(=O)O)C(=O)O WGK Alemania 3 Número ONU 3261 Peso molecular 144.13 Beilstein 2046031 Reaxy-Rn 2046031 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2046031&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 Clase Carboxylic acids and derivatives Subclass Dicarboxylic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Dicarboxylic acids and derivatives Alternative Parents Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aliphatic homomonocyclic compounds Substituents Dicarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound Descripción This compound belongs to the class of organic compounds known as dicarboxylic acids and derivatives. These are organic compounds containing exactly two carboxylic acid groups. External Descriptors cyclobutanedicarboxylic acid 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.
Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Punto de fusión (°C) 158°C Peso molecular 144.120 g/mol XLogP3 0.400 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 2 Exact Mass 144.042 Da Monoisotopic Mass 144.042 Da Topological Polar Surface Area 74.600 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 164.000 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
Citations of This Product Referencias 1. Lihua Chen, Pan Zhao, Jing Yang, Xiali Liao, Bo Yang, Chuanzhu Gao. (2022) Synthesis, characterization, and antitumor biological evaluation of novel fluorine-containing platinum (IV) complexes. APPLIED ORGANOMETALLIC CHEMISTRY, 36 (7): (e6759). [PMID: [10.1002/aoc.6759 ] 2. Chunyan Jia, Yanwei Cong, Shaoping Pu, Linxiang Cai, Yunshuang Zhong, Xinzhong Zhang, Xiali Liao, Yamin Li, Bo Yang, Chuanzhu Gao. (2020) Synthesis, characterization, and biological activity of new mixed ammine/amine platinum(IV) complexes. APPLIED ORGANOMETALLIC CHEMISTRY, 34 (8): (e5680). [PMID: [10.1002/aoc.5680 ]
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