Arotinoid; Arotinoid ethyl ester

HCID 104969
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Basic information

Standard SMILES
CCOC(=O)c1ccc(C=C(C)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1
InChIKey
NULUAKSYPPSJCO-UHFFFAOYSA-N
Molecular formula
C26H32O2
Average molar mass
376.5 g/mol

Names & identifiers

Preferred name
Arotinoid; Arotinoid ethyl ester
IUPAC
ethyl 4-[2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzoate

Names & synonyms

Arotinoid; Arotinoid ethyl esterSCHEMBL2890176

Database identifiers

PubChem CID
104969

Properties

Computed structural properties

XLogP
8.2
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
28

Related reactions

2 records
New reaction record

Compound notes

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