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· · COA & SDS available for every product · Same-day shipping on in-stock items 6-Methoxy-benzo[1,3]dioxole-5-carbaldehyde - ≥97% , CAS No.5780-00-7
Synonyms
PD002164 | 6-Methoxy-1,3-benzodioxole-5-carbaldehyde | HMS2512G07 | 6-Methoxy-benzo[1,3]dioxole-5-carbaldehyde | 6-Methoxy-1,3-benzodioxole-5-carbaldehyde, 97% | MFCD00598413 | NCGC00258997-01 | F0919-4623 | 6-Methoxy-1,3-benzodioxole-5-carbaldehyde # | S
Storage
Room temperature,Argon charged
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Argon charged 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
PD002164 | 6-Methoxy-1, 3-benzodioxole-5-carbaldehyde | HMS2512G07 | 6-Methoxy-benzo[1, 3]dioxole-5-carbaldehyde | 6-Methoxy-1, 3-benzodioxole-5-carbaldehyde, 97% | MFCD00598413 | NCGC00258997-01 | F0919-4623 | 6-Methoxy-1, 3-benzodioxole-5-carbaldehyde # | S
Specifications & Purity
≥97%
Storage
Room temperature, Argon charged
Names and Identifiers Pubchem Sid 488190630 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488190630 Canonical Smiles COC1=CC2=C(C=C1C=O)OCO2 IUPAC Name 6-methoxy-1,3-benzodioxole-5-carbaldehyde InChIKey NCIYDDIPUGCVKX-UHFFFAOYSA-N INCHI 1S/C9H8O4/c1-11-7-3-9-8(12-5-13-9)2-6(7)4-10/h2-4H,5H2,1H3 Isomeric SMILES COC1=CC2=C(C=C1C=O)OCO2 Molecular Weight 180.16 Reaxy-Rn 176809 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=176809&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 Organoheterocyclic compounds Class Benzodioxoles Subclass Not available Intermediate Tree Nodes Not available Direct Parent Benzodioxoles Alternative Parents Anisoles Aryl-aldehydes Alkyl aryl ethers Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Benzodioxole - Anisole - Aryl-aldehyde - Alkyl aryl ether - Benzenoid - Oxacycle - Ether - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic heteropolycyclic compound Description 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.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Air sensitive Refractive Index n20D1.59 (Predicted) Boil Point(°C) 302.54° C at 760 mmHg (Predicted) Melt Point(°C) 109 - 115 °C Molecular Weight 180.160 g/mol XLogP3 1.200 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 2 Exact Mass 180.042 Da Monoisotopic Mass 180.042 Da Topological Polar Surface Area 44.800 Ų Heavy Atom Count 13 Formal Charge 0 Complexity 194.000 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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