Methyl 4-fluoropicolinate - ≥97% , CAS No.886371-79-5

CAS: 886371-79-5 Cat. No.: M177985 Formula: C₇H₆FNO₂ Peso molecolare: 155.1264

GRADE & PURITY ≥97%

Synonyms

AKOS006285849 | SCHEMBL2305000 | Methyl 4-fluoropicolinate | Methyl4-fluoropicolinate | Methyl 4-fluoropyridine-2-carboxylate | SY240688 | DTXSID40673217 | J-515427 | FT-0693558 | A861640 | MFCD07374898 | DS-10884 | 4-Fluoro-pyridine-2-carboxylic acid met

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinonimi

AKOS006285849 | SCHEMBL2305000 | Methyl 4-fluoropicolinate | Methyl4-fluoropicolinate | Methyl 4-fluoropyridine-2-carboxylate | SY240688 | DTXSID40673217 | J-515427 | FT-0693558 | A861640 | MFCD07374898 | DS-10884 | 4-Fluoro-pyridine-2-carboxylic acid met

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature,Argon charged

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

• Pubchem Sid: 488201283
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488201283
• Sorrisi canonici: COC(=O)C1=NC=CC(=C1)F
• IUPAC Name: methyl 4-fluoropyridine-2-carboxylate
• InChIKey: WVUMSXSSXWAGJM-UHFFFAOYSA-N
• INCHI: 1S/C7H6FNO2/c1-11-7(10)6-4-5(8)2-3-9-6/h2-4H,1H3
• Isomeri SMILES: COC(=O)C1=NC=CC(=C1)F
• Peso molecolare: 155.1264
• Reaxy-Rn: 27136435
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=27136435&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Pyridines and derivatives
      • Subclass Pyridinecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Pyridines and derivatives
• Subclass: Pyridinecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinecarboxylic acids
• Alternative Parents: Aryl fluorides Methyl esters Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridine carboxylic acid - Aryl fluoride - Aryl halide - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid 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.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive
• Peso molecolare: 155.130 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 155.038 Da
• Monoisotopic Mass: 155.038 Da
• Topological Polar Surface Area: 39.200 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 151.000
• 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