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4-Bromo-2-cyclohexyl-phenol

HCID 22134516
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Oc1ccc(Br)cc1C1CCCCC1
InChIKey
QQVRKOIEEIGPMK-UHFFFAOYSA-N
Molecular formula
C12H15BrO
Average molar mass
255.15 g/mol

Names & identifiers

Preferred name
4-Bromo-2-cyclohexyl-phenol
IUPAC
4-bromo-2-cyclohexylphenol

Names & synonyms

4-bromo-2-cyclohexyl-phenol18966-67-14-bromo-2-cyclohexylphenol2-cyclohexyl-4-bromophenolSCHEMBL573920QQVRKOIEEIGPMK-UHFFFAOYSA-NA1-25907

Database identifiers

PubChem CID
22134516

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
Formal charge
0
Complexity
177

Related reactions

4 records
New reaction record
HRID 318622 reaction equation
HRID 318622As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1805138 reaction equation
HRID 1805138As productuspto-grants-2013_01
HRID 1915479 reaction equation
HRID 1915479As productuspto-grants-2013_12
HRID 2404877 reaction equation
HRID 2404877As productuspto-grants-2014_08

Compound notes

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