2-Butyl-6-fluoro-5-hydroxy-1-indanone

HCID 21990885
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCC1Cc2cc(O)c(F)cc2C1=O
InChIKey
SXVIZHQJVDIBDH-UHFFFAOYSA-N
Molecular formula
C13H15FO2
Average molar mass
222.25 g/mol

Names & identifiers

Preferred name
2-Butyl-6-fluoro-5-hydroxy-1-indanone
IUPAC
2-butyl-6-fluoro-5-hydroxy-2,3-dihydroinden-1-one

Names & synonyms

SCHEMBL2413944SXVIZHQJVDIBDH-UHFFFAOYSA-N2-butyl-6-fluoro-5-hydroxy-1-indanone

Database identifiers

PubChem CID
21990885

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
16

Related reactions

4 records
New reaction record

Compound notes

Loading…