5-(p-Cyclooctyl-phenoxy)-pentanoic acid ethyl ester

HCID 54371205
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Basic information

Standard SMILES
CCOC(=O)CCCCOc1ccc(C2CCCCCCC2)cc1
InChIKey
UTIMKZPGOIQIPL-UHFFFAOYSA-N
Molecular formula
C21H32O3
Average molar mass
332.5 g/mol

Names & identifiers

Preferred name
5-(p-Cyclooctyl-phenoxy)-pentanoic acid ethyl ester
IUPAC
ethyl 5-(4-cyclooctylphenoxy)pentanoate

Names & synonyms

SCHEMBL11718674UTIMKZPGOIQIPL-UHFFFAOYSA-N5-(p-cyclooctyl-phenoxy)-pentanoic acid ethyl ester

Database identifiers

PubChem CID
54371205

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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