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(2'-Fluoro-2-(2-methylcyclopentyl)-5'-(methyloxy)-1,1'-biphenyl-4-yl)methanol

HCID 57706147
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(F)c(-c2ccc(CO)cc2C2CCCC2C)c1
InChIKey
QGRUOUZZSUMQBU-UHFFFAOYSA-N
Molecular formula
C20H23FO2
Average molar mass
314.4 g/mol

Names & identifiers

Preferred name
(2'-Fluoro-2-(2-methylcyclopentyl)-5'-(methyloxy)-1,1'-biphenyl-4-yl)methanol
IUPAC
[4-(2-fluoro-5-methoxyphenyl)-3-(2-methylcyclopentyl)phenyl]methanol

Names & synonyms

SCHEMBL2504024QGRUOUZZSUMQBU-UHFFFAOYSA-N(2'-Fluoro-2-(2-methylcyclopentyl)-5'-(methyloxy)-1,1'-biphenyl-4-yl)methanol

Database identifiers

PubChem CID
57706147

Properties

Computed structural properties

XLogP
5
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
23
Formal charge
0
Complexity
375

Related reactions

2 records
New reaction record
HRID 104947 reaction equation
HRID 104947As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1662456 reaction equation
HRID 1662456As productuspto-grants-2011_10

Compound notes

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