4-(3,3-Dimethylbutoxy)benzaldehyde

HCID 10242087
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)CCOc1ccc(C=O)cc1
InChIKey
UAAKHTWSOSCEQX-UHFFFAOYSA-N
Molecular formula
C13H18O2
Average molar mass
206.28 g/mol

Names & identifiers

Preferred name
4-(3,3-Dimethylbutoxy)benzaldehyde
IUPAC
4-(3,3-dimethylbutoxy)benzaldehyde

Names & synonyms

4-(3,3-dimethylbutoxy)benzaldehydeSCHEMBL16894536UAAKHTWSOSCEQX-UHFFFAOYSA-N4-(3,3-dimethylbutoxyl)benzaldehyde

Database identifiers

PubChem CID
10242087

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
15

Related reactions

1 records
New reaction record

Compound notes

Loading…