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1-Cyclohexyl-3-(2-hydroxy-5-bromophenyl)propanol

HCID 20163633
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Oc1ccc(Br)cc1CCC(O)C1CCCCC1
InChIKey
LTQPMIQDRYQEIL-UHFFFAOYSA-N
Molecular formula
C15H21BrO2
Average molar mass
313.23 g/mol

Names & identifiers

Preferred name
1-Cyclohexyl-3-(2-hydroxy-5-bromophenyl)propanol
IUPAC
4-bromo-2-(3-cyclohexyl-3-hydroxypropyl)phenol

Names & synonyms

SCHEMBL10369056LTQPMIQDRYQEIL-UHFFFAOYSA-N1-cyclohexyl-3-(2-hydroxy-5-bromophenyl)propanol

Database identifiers

PubChem CID
20163633

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
40.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
18
Formal charge
0
Complexity
241

Related reactions

1 records
New reaction record
HRID 256412 reaction equation
HRID 256412As reactantuspto-grants-1987_10

Compound notes

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