6'-bromo-4-ethoxyspiro[cyclohexane-1,2'-inden]-1'(3'H)-one

HCID 58196992
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC1CCC2(CC1)Cc1ccc(Br)cc1C2=O
InChIKey
JGPOGFFRQZDVRK-UHFFFAOYSA-N
Molecular formula
C16H19BrO2
Average molar mass
323.22 g/mol

Names & identifiers

Preferred name
6'-bromo-4-ethoxyspiro[cyclohexane-1,2'-inden]-1'(3'H)-one
IUPAC
6-bromo-4'-ethoxyspiro[3H-indene-2,1'-cyclohexane]-1-one

Names & synonyms

6'-bromo-4-ethoxyspiro[cyclohexane-1,2'-inden]-1'(3'H)-one1245515-77-8SCHEMBL1464631SCHEMBL1465376JGPOGFFRQZDVRK-UHFFFAOYSA-N

Database identifiers

PubChem CID
58196992

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
19

Related reactions

3 records
New reaction record

Compound notes

Loading…