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2-((Trimethylsilyl)ethynyl)pyridin-3-ol - Reagent Grade, high purity , CAS No.556832-92-9
Basic Description
Synonyms
2-[(Trimethylsilyl)ethynyl]pyridin-3-ol | 2-(2-trimethylsilylethynyl)pyridin-3-ol | 2-(Trimethylsilylethynyl)pyridin-3-ol | 2-((Trimethylsilyl)ethynyl)pyridin-3-ol, AldrichCPR | DTXSID50674053 | 2-((Trimethylsilyl)ethynyl)pyridin-3-ol | MFCD12922737 | AKO
Specifications & Purity
Reagent grade
Legal Information
Product of Adesis
Grade
Reagent Grade
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Hydroxypyridines
Intermediate Tree Nodes
Not available
Direct Parent
Hydroxypyridines
Alternative Parents
Heteroaromatic compounds Trialkylsilanes Organic metalloid salts Azacyclic compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydroxypyridine - Heteroaromatic compound - Trialkylsilane - Azacycle - Organic metalloid salt - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organosilicon compound - Alkylsilane - Organooxygen compound - Organonitrogen compound - Organic metalloid moeity - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hydroxypyridines. These are organic compounds containing a pyridine ring substituted at one or more positions by a hydroxyl 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.
Names and Identifiers
IUPAC Name
2-(2-trimethylsilylethynyl)pyridin-3-ol
INCHI
InChI=1S/C10H13NOSi/c1-13(2,3)8-6-9-10(12)5-4-7-11-9/h4-5,7,12H,1-3H3
InChIKey
XGERZIBGPZAWHY-UHFFFAOYSA-N
Smiles
C[Si](C)(C)C#CC1=C(C=CC=N1)O
Isomeric SMILES
C[Si](C)(C)C#CC1=C(C=CC=N1)O
PubChem CID
46737862
Molecular Weight
191.31
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
191.300 g/mol
XLogP3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
191.077 Da
Monoisotopic Mass
191.077 Da
Topological Polar Surface Area
33.100 Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
232.000
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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