4-[(4-Bromophenyl)(cyclohexylidene)methyl]phenol

HCID 68654533

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: Oc1ccc(C(=C2CCCCC2)c2ccc(Br)cc2)cc1
InChIKey: WRFHBNCLVDNWQN-UHFFFAOYSA-N
Molecular formula: C19H19BrO
Average molar mass: 343.3 g/mol

Names & identifiers

Preferred name: 4-[(4-Bromophenyl)(cyclohexylidene)methyl]phenol
IUPAC: 4-[(4-bromophenyl)-cyclohexylidenemethyl]phenol

Names & synonyms

SCHEMBL3468461WRFHBNCLVDNWQN-UHFFFAOYSA-N4-[(4-Bromophenyl)(cyclohexylidene)methyl]phenol

Database identifiers

PubChem CID: 68654533

Properties

Computed structural properties

XLogP: 6.3
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 2
Heavy atoms: 21
Formal charge: 0
Complexity: 352

Related reactions

9 records

New reaction record

HRID 174321As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 229130As productuspto-grants-2009_07

HRID 229131As reactantuspto-grants-2009_07

HRID 1127408As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1229308As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

HRID 1715984As productuspto-grants-2010_09

HRID 1715985As reactantuspto-grants-2010_09

HRID 2100024As productuspto-grants-2009_08

Compound notes

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