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(6-Fluoro-2',6'-dimethylbiphenyl-3-yl)methanol

HCID 57787552
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1cccc(C)c1-c1cc(CO)ccc1F
InChIKey
PLYXZMYDYZSNAD-UHFFFAOYSA-N
Molecular formula
C15H15FO
Average molar mass
230.28 g/mol

Names & identifiers

Preferred name
(6-Fluoro-2',6'-dimethylbiphenyl-3-yl)methanol
IUPAC
[3-(2,6-dimethylphenyl)-4-fluorophenyl]methanol

Names & synonyms

SCHEMBL2026166PLYXZMYDYZSNAD-UHFFFAOYSA-N(6-fluoro-2',6'-dimethylbiphenyl-3-yl)methanolA1-57953(6-Fluoro-2',6'-dimethyl-[1,1'-biphenyl]-3-yl)methanol

Database identifiers

PubChem CID
57787552

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
233

Related reactions

2 records
New reaction record
HRID 836445 reaction equation
HRID 836445As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 2426754 reaction equation
HRID 2426754As productuspto-grants-2011_06

Compound notes

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