(+/-)-5-[1-(4'-Tert-butyl-2,6-dimethyl-biphenyl-4-yloxy)-ethyl]-thiophene-2-carboxylic acid ethyl ester

HCID 67484337
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Basic information

Standard SMILES
CCOC(=O)c1ccc(C(C)Oc2cc(C)c(-c3ccc(C(C)(C)C)cc3)c(C)c2)s1
InChIKey
FWEHOVJFASDGHJ-UHFFFAOYSA-N
Molecular formula
C27H32O3S
Average molar mass
436.6 g/mol
Monoisotopic mass
436.20721605

Names & identifiers

Preferred name
(+/-)-5-[1-(4'-Tert-butyl-2,6-dimethyl-biphenyl-4-yloxy)-ethyl]-thiophene-2-carboxylic acid ethyl ester
IUPAC
ethyl 5-[1-[4-(4-tert-butylphenyl)-3,5-dimethylphenoxy]ethyl]thiophene-2-carboxylate

Names & synonyms

SCHEMBL2652594FWEHOVJFASDGHJ-UHFFFAOYSA-N(+/-)-5-[1-(4'-tert-butyl-2,6-dimethyl-biphenyl-4-yloxy)-ethyl]-thiophene-2-carboxylic acid ethyl ester

Database identifiers

PubChem CID
67484337

Properties

Computed structural properties

XLogP
8.1
Topological polar surface area
63.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
31

Related reactions

4 records
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Compound notes

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