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· · COA & SDS available for every product · Same-day shipping on in-stock items 1-Methyl-1,5,6,7-tetrahydro-4H-indazol-4-one - ≥97% , CAS No.85302-16-5
Synonyms
J-504845 | MFCD00930489 | 10N-510S | STL557236 | AKOS000320443 | F2124-1026 | DTXSID80377565 | FT-0685059 | SCHEMBL1986758 | EN300-35487 | Kinome_3369 | Z336028554 | 1-methyl-4,5,6,7-tetrahydro-1H-indazol-4-one | 1-Methyl-1,5,6,7-tetrahydroindazol-4-one |
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice 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
J-504845 | MFCD00930489 | 10N-510S | STL557236 | AKOS000320443 | F2124-1026 | DTXSID80377565 | FT-0685059 | SCHEMBL1986758 | EN300-35487 | Kinome_3369 | Z336028554 | 1-methyl-4, 5, 6, 7-tetrahydro-1H-indazol-4-one | 1-Methyl-1, 5, 6, 7-tetrahydroindazol-4-one |
Specifications & Purity
≥97%
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles CN1C2=C(C=N1)C(=O)CCC2 IUPAC Name 1-methyl-6,7-dihydro-5H-indazol-4-one InChIKey PWZFWKUHDMFIAL-UHFFFAOYSA-N INCHI 1S/C8H10N2O/c1-10-7-3-2-4-8(11)6(7)5-9-10/h5H,2-4H2,1H3 Isomeric SMILES CN1C2=C(C=N1)C(=O)CCC2 Alternate CAS 85302-16-5 PubChem CID 2765796 Molecular Weight 150.18
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 oxygen compounds Class Organooxygen compounds Subclass Carbonyl compounds Intermediate Tree Nodes Ketones - Aryl ketones Direct Parent Aryl alkyl ketones Alternative Parents Vinylogous amides Pyrazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Aryl alkyl ketone - Heteroaromatic compound - Vinylogous amide - Pyrazole - Azole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group. 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 150.180 g/mol XLogP3 0.400 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 0 Exact Mass 150.079 Da Monoisotopic Mass 150.079 Da Topological Polar Surface Area 34.900 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 181.000 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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