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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino 3-(3,4-Methylenedioxyphenyl)propionic acid - ≥98% , CAS No.2815-95-4
Synonyms
1,3-Benzodioxole-5-propionic acid | 3-(2,4-dihydroxy-3-methylene-cyclohexyl)propanoic acid | A819352 | 3-(BENZO(D)(1,3)DIOXOL-5-YL)PROPANOIC ACID | 3-(BENZO(1,3)DIOXOL-5-YL)PROPIONIC ACID | 3,4-Methylenedioxydihydrocinnamic acid | AI3-19943 | NSC 55524 |
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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 Sinonimi
1,3-Benzodioxole-5-propionic acid | 3-(2,4-dihydroxy-3-methylene-cyclohexyl)propanoic acid | A819352 | 3-(BENZO(D)(1,3)DIOXOL-5-YL)PROPANOIC ACID | 3-(BENZO(1,3)DIOXOL-5-YL)PROPIONIC ACID | 3,4-Methylenedioxydihydrocinnamic acid | AI3-19943 | NSC 55524 |
Condizioni di conservazione di stoccaggio
Room temperature
Nomi e identificatori Sorrisi canonici
C1OC2=C(O1)C=C(C=C2)CCC(=O)O
IUPAC Name
3-(1,3-benzodioxol-5-yl)propanoic acid
InChIKey
UIYJGLLTSVRSBM-UHFFFAOYSA-N
INCHI
1S/C10H10O4/c11-10(12)4-2-7-1-3-8-9(5-7)14-6-13-8/h1,3,5H,2,4,6H2,(H,11,12)
Isomeri SMILES
C1OC2=C(O1)C=C(C=C2)CCC(=O)O
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=181735&ln=
Documentazione 📋 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 Organoheterocyclic compounds Classe Benzodioxoles Subclass Not available Intermediate Tree Nodes Not available Direct Parent Benzodioxoles Alternative Parents Benzenoids Oxacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds Molecular Framework Aromatic heteropolycyclic compounds Substituents Benzodioxole - Benzenoid - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound Descrizione This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three 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.
Struttura 3D Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Solubilità Soluble in chloroform and ethyl acetate. Punto di fusione (°C) 83-87°C Peso molecolare 194.180 g/mol XLogP3 1.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 3 Exact Mass 194.058 Da Monoisotopic Mass 194.058 Da Topological Polar Surface Area 55.800 Ų Heavy Atom Count 14 Formal Charge 0 Complexity 216.000 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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