EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:109014 - 4-methyl-6-(2,2,3,3,4,4,5,5-octafluoropentoxy)-2-pyrimidinamine

ChEBI IDCHEBI:109014
ChEBI Name4-methyl-6-(2,2,3,3,4,4,5,5-octafluoropentoxy)-2-pyrimidinamine
Stars
DownloadsMolfile
FormulaC10H9F8N3O
Net Charge0
Average Mass339.186
Monoisotopic Mass339.06179
SMILESCc1cc(OCC(F)(F)C(F)(F)C(F)(F)C(F)F)nc(N)n1
InChIInChI=1S/C10H9F8N3O/c1-4-2-5(21-7(19)20-4)22-3-8(13,14)10(17,18)9(15,16)6(11)12/h2,6H,3H2,1H3,(H2,19,20,21)
InChIKeyPYLQFLPNCXPNNY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
4-methyl-6-(2,2,3,3,4,4,5,5-octafluoropentoxy)-2-pyrimidinamine (CHEBI:109014) is a aminopyrimidine (CHEBI:38338)
Manual XrefsDatabases
LSM-20412LINCS