Ethyl 4-[2-[8-(2-ethoxy-2-oxoethyl)-8-hydroxy-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]ethenyl]benzoate

HCID 54565192
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Basic information

Standard SMILES
CCOC(=O)CC1(O)CCC(C)(C)c2ccc(C=Cc3ccc(C(=O)OCC)cc3)cc21
InChIKey
ZTHVCZPWGICCIW-UHFFFAOYSA-N
Molecular formula
C27H32O5
Average molar mass
436.5 g/mol

Names & identifiers

Preferred name
Ethyl 4-[2-[8-(2-ethoxy-2-oxoethyl)-8-hydroxy-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]ethenyl]benzoate
IUPAC
ethyl 4-[2-[8-(2-ethoxy-2-oxoethyl)-8-hydroxy-5,5-dimethyl-6,7-dihydronaphthalen-2-yl]ethenyl]benzoate

Database identifiers

PubChem CID
54565192

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
72.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
32

Related reactions

2 records
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Compound notes

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