2-(fluoromethyl)-4-hydroxy-1H-pyrimidin-6-one - ≥97% , CAS No.1480-98-4

CAS: 1480-98-4 Cat. No.: H629402 Molecular Weight: 144.1 PubChem CID: 59343540

GRADE & PURITY ≥97%

Synonyms

2-(Fluoromethyl)pyrimidine-4,6-diol | SCHEMBL2117891 | DTXSID801250323 | F89748 | PS-19420 | 2-(Fluoromethyl)-6-hydroxy-4(3H)-pyrimidinone | 2-fluoromethyl-4,6-dihydroxypyrimidine | KSKKRTWBCQYQNB-UHFFFAOYSA-N | 2-(fluoromethyl)-4-hydroxy-1H-pyrimidin-6-o

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2-(Fluoromethyl)pyrimidine-4, 6-diol | SCHEMBL2117891 | DTXSID801250323 | F89748 | PS-19420 | 2-(Fluoromethyl)-6-hydroxy-4(3H)-pyrimidinone | 2-fluoromethyl-4, 6-dihydroxypyrimidine | KSKKRTWBCQYQNB-UHFFFAOYSA-N | 2-(fluoromethyl)-4-hydroxy-1H-pyrimidin-6-o

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1=C(N=C(NC1=O)CF)O
• IUPAC Name: 2-(fluoromethyl)-4-hydroxy-1H-pyrimidin-6-one
• InChIKey: KSKKRTWBCQYQNB-UHFFFAOYSA-N
• INCHI: 1S/C5H5FN2O2/c6-2-3-7-4(9)1-5(10)8-3/h1H,2H2,(H2,7,8,9,10)
• Isomeric SMILES: C1=C(N=C(NC1=O)CF)O
• Alternate CAS: 1480-98-4
• PubChem CID: 59343540
• Molecular Weight: 144.1

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazines
      • Subclass Pyrimidines and pyrimidine derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazines
• Subclass: Pyrimidines and pyrimidine derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Hydroxypyrimidines
• Alternative Parents: Pyrimidones Hydropyrimidines Vinylogous acids Heteroaromatic compounds Lactams Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyrimidone - Hydroxypyrimidine - Hydropyrimidine - Vinylogous acid - Heteroaromatic compound - Lactam - Azacycle - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl fluoride - Organic nitrogen compound - Alkyl halide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as hydroxypyrimidines. These are organic compounds containing a hydroxyl group attached to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
• 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