CHEBI:44903 - 2,3,4,5,6-pentafluorobenzyl alcohol

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ChEBI Name 2,3,4,5,6-pentafluorobenzyl alcohol
ChEBI ID CHEBI:44903
Definition An organofluorine compound that is benzyl alcohol substituted by fluoro groups at positions 2, 3, 4, 5 and 6.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C7H3F5O
Net Charge 0
Average Mass 198.09010
Monoisotopic Mass 198.01041
InChI InChI=1S/C7H3F5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h13H,1H2
InChIKey PGJYYCIOYBZTPU-UHFFFAOYSA-N
SMILES OCc1c(F)c(F)c(F)c(F)c1F
ChEBI Ontology
Outgoing 2,3,4,5,6-pentafluorobenzyl alcohol (CHEBI:44903) is a benzyl alcohols (CHEBI:22743)
2,3,4,5,6-pentafluorobenzyl alcohol (CHEBI:44903) is a organofluorine compound (CHEBI:37143)
IUPAC Name
(pentafluorophenyl)methanol
Synonym Source
pentafluorobenzyl alcohol NIST Chemistry WebBook
Manual Xref Database
PFB PDBeChem
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Registry Numbers Types Sources
2052669 Reaxys Registry Number Reaxys
440-60-8 CAS Registry Number ChemIDplus
440-60-8 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
12501206 PubMed citation Europe PMC
8172897 PubMed citation Europe PMC
Last Modified
27 August 2014