6-(4'-Decyloxybenzoyloxy)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid benzyl ester

HCID 54439972
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Basic information

Standard SMILES
CCCCCCCCCCOc1ccc(C(=O)OC2CCc3cc(C(=O)OCc4ccccc4)ccc3C2)cc1
InChIKey
WNKLPYVQIHXIFX-UHFFFAOYSA-N
Molecular formula
C35H42O5
Average molar mass
542.7 g/mol
Monoisotopic mass
542.30322444

Names & identifiers

Preferred name
6-(4'-Decyloxybenzoyloxy)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid benzyl ester
IUPAC
benzyl 6-(4-decoxybenzoyl)oxy-5,6,7,8-tetrahydronaphthalene-2-carboxylate

Names & synonyms

SCHEMBL8533556WNKLPYVQIHXIFX-UHFFFAOYSA-N6-(4'-decyloxybenzoyloxy)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid benzyl ester

Database identifiers

PubChem CID
54439972

Properties

Computed structural properties

XLogP
10
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
17
Heavy atoms
40

Related reactions

3 records
New reaction record

Linked notes

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