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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items 3-ethynyl-1-methyl-1H-pyrazole - ≥97% , CAS No.61514-59-8
Synonyms
SB10565 | SCHEMBL1923035 | 3-ethynyl-1-methyl-1H-pyrazole | F78154 | DTXSID30486015 | PS-17490 | Z1343579282 | MFCD23767398 | EN300-187737 | STL584592 | 3-ethynyl-1-methylpyrazole | AKOS015921061
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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 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 Sinónimos
SB10565 | SCHEMBL1923035 | 3-ethynyl-1-methyl-1H-pyrazole | F78154 | DTXSID30486015 | PS-17490 | Z1343579282 | MFCD23767398 | EN300-187737 | STL584592 | 3-ethynyl-1-methylpyrazole | AKOS015921061
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Nombres e identificadores Sonrisas canónicas
CN1C=CC(=N1)C#C
IUPAC Name
3-ethynyl-1-methylpyrazole
InChIKey
GMCPKTQIHQISHX-UHFFFAOYSA-N
INCHI
1S/C6H6N2/c1-3-6-4-5-8(2)7-6/h1,4-5H,2H3
Isómeros SMILES
CN1C=CC(=N1)C#C
CAS alternativo
61514-59-8
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 Clase Azoles Subclass Pyrazoles Intermediate Tree Nodes Not available Direct Parent Pyrazoles Alternative Parents Heteroaromatic compounds Azacyclic compounds Acetylides Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Molecular Framework Aromatic heteromonocyclic compounds Substituents Heteroaromatic compound - Pyrazole - Acetylide - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound Descripción This compound belongs to the class of organic compounds known as pyrazoles. These are compounds containing a pyrazole ring, which is a five-member aromatic ring with two nitrogen atoms (at positions 1 and 2) 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.
Estructura 3D Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Peso molecular 106.130 g/mol XLogP3 0.500 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 1 Exact Mass 106.053 Da Monoisotopic Mass 106.053 Da Topological Polar Surface Area 17.800 Ų Heavy Atom Count 8 Formal Charge 0 Complexity 122.000 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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