Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
3-(12-Bromododecyl)-pyridine
HCID
58017444
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
BrCCCCCCCCCCCCc1cccnc1
InChIKey
QZOOSHKEKNXJKT-UHFFFAOYSA-N
Molecular formula
C17H28BrN
Average molar mass
326.3 g/mol
Monoisotopic mass
325.14051
Names & identifiers
Preferred name
3-(12-Bromododecyl)-pyridine
IUPAC
3-(12-bromododecyl)pyridine
Names & synonyms
SCHEMBL741967
3-(12-bromododecyl)-pyridine
QZOOSHKEKNXJKT-UHFFFAOYSA-N
12-(pyridin-3-yl)-1-bromododecane
Database identifiers
PubChem CID
58017444
Properties
Computed structural properties
XLogP
6.6
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
12
Heavy atoms
19
Formal charge
0
Complexity
184
Show all 8
Show all 8 / 8
Related reactions
1 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
243585
As product
uspto-grants-2014_02
Compound notes
Loading…