2-Benzoyl-5-(4-t-butyl-phenoxy)thiophene

HCID 19935313
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Basic information

Standard SMILES
CC(C)(C)c1ccc(Oc2ccc(C(=O)c3ccccc3)s2)cc1
InChIKey
CNYCBUJVIOVYAX-UHFFFAOYSA-N
Molecular formula
C21H20O2S
Average molar mass
336.4 g/mol
Monoisotopic mass
336.11840105

Names & identifiers

Preferred name
2-Benzoyl-5-(4-t-butyl-phenoxy)thiophene
IUPAC
[5-(4-tert-butylphenoxy)thiophen-2-yl]-phenylmethanone

Names & synonyms

SCHEMBL9147750CNYCBUJVIOVYAX-UHFFFAOYSA-N2-benzoyl-5-(4-t-butyl-phenoxy)thiophene

Database identifiers

PubChem CID
19935313

Properties

Computed structural properties

XLogP
6.8
Topological polar surface area
54.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
24

Related reactions

3 records
New reaction record

Linked notes

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