2-(4-Decyloxyphenyl)-5-acetylbenzoxazole

HCID 19021153
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCCCCCCCOc1ccc(-c2nc3cc(C(C)=O)ccc3o2)cc1
InChIKey
LUYBQYMJPOGPGQ-UHFFFAOYSA-N
Molecular formula
C25H31NO3
Average molar mass
393.5 g/mol

Names & identifiers

Preferred name
2-(4-Decyloxyphenyl)-5-acetylbenzoxazole
IUPAC
1-[2-(4-decoxyphenyl)-1,3-benzoxazol-5-yl]ethanone

Names & synonyms

SCHEMBL8307428LUYBQYMJPOGPGQ-UHFFFAOYSA-N2-(4-decyloxyphenyl)-5-acetylbenzoxazole2-(4-decyloxyphenyl)-5-acetylbenzooxazole

Database identifiers

PubChem CID
19021153

Properties

Computed structural properties

XLogP
7.6
Topological polar surface area
52.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
12
Heavy atoms
29

Related reactions

3 records
New reaction record

Linked notes

Loading…