Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
2-Bromo-1-cyclobutylylethanone
HCID
86646407
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
O=CC=C1CCC1Br
InChIKey
QYGAXAAETBUDOS-UHFFFAOYSA-N
Molecular formula
C6H7BrO
Average molar mass
175.02 g/mol
Names & identifiers
Preferred name
2-Bromo-1-cyclobutylylethanone
IUPAC
2-(2-bromocyclobutylidene)acetaldehyde
Names & synonyms
2-Bromo-1-cyclobutylylethanone
QYGAXAAETBUDOS-UHFFFAOYSA-N
Database identifiers
PubChem CID
86646407
Properties
Computed structural properties
XLogP
0.8
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
8
Formal charge
0
Complexity
128
Show all 8
Show all 8 / 8
Related reactions
3 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
388691
As reactant
uspto-grants-2013_02
HRID
880788
As reactant
uspto-grants-2015_03
HRID
925972
As reactant
uspto-grants-2016_03
Compound notes
Loading…