methyl 4-[3-fluoro-5-(4-methoxy-3,4,5,6-tetrahydro-2H-pyran-4-yl)phenoxymethyl]benzoate

HCID 22246346
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Basic information

Standard SMILES
COC(=O)c1ccc(COc2cc(F)cc(C3(OC)CCOCC3)c2)cc1
InChIKey
UPQZNLHXNARQNS-UHFFFAOYSA-N
Molecular formula
C21H23FO5
Average molar mass
374.4 g/mol

Names & identifiers

Preferred name
methyl 4-[3-fluoro-5-(4-methoxy-3,4,5,6-tetrahydro-2H-pyran-4-yl)phenoxymethyl]benzoate
IUPAC
methyl 4-[[3-fluoro-5-(4-methoxyoxan-4-yl)phenoxy]methyl]benzoate

Names & synonyms

SCHEMBL6024923UPQZNLHXNARQNS-UHFFFAOYSA-Nmethyl 4-[3-fluoro-5-(4-methoxy-3,4,5,6-tetrahydro-2H-pyran-4-yl)phenoxymethyl]benzoate

Database identifiers

PubChem CID
22246346

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
54 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
27

Related reactions

3 records
New reaction record

Compound notes

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