5-Bromo-4'-methoxy-3H-spiro[benzofuran-2,1'-cyclohexan]-3-imine

HCID 67979544
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COC1CCC2(CC1)Oc1ccc(Br)cc1C2=N
InChIKey
HVSOTCVOBHIYQW-UHFFFAOYSA-N
Molecular formula
C14H16BrNO2
Average molar mass
310.19 g/mol

Names & identifiers

Preferred name
5-Bromo-4'-methoxy-3H-spiro[benzofuran-2,1'-cyclohexan]-3-imine
IUPAC
5-bromo-4'-methoxyspiro[1-benzofuran-2,1'-cyclohexane]-3-imine

Names & synonyms

SCHEMBL9948372HVSOTCVOBHIYQW-UHFFFAOYSA-N5-Bromo-4'-methoxy-3H-spiro[benzofuran-2,1'-cyclohexan]-3-imine

Database identifiers

PubChem CID
67979544

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
42.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
18

Related reactions

8 records
New reaction record

Compound notes

Loading…