Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
3-Bromo-5-nitro-2,3'-bipyridin-6-amine (HCID 59596002)|Huagongshe
Home
/
Compound
3-Bromo-5-nitro-2,3'-bipyridin-6-amine
HCID
59596002
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
Nc1nc(-c2cccnc2)c(Br)cc1[N+](=O)[O-]
InChIKey
GTSWWZQRFNEHQE-UHFFFAOYSA-N
Molecular formula
C10H7BrN4O2
Average molar mass
295.09 g/mol
Names & identifiers
Preferred name
3-Bromo-5-nitro-2,3'-bipyridin-6-amine
IUPAC
5-bromo-3-nitro-6-pyridin-3-ylpyridin-2-amine
Names & synonyms
SCHEMBL3791733
GTSWWZQRFNEHQE-UHFFFAOYSA-N
3-Bromo-5-nitro-2,3'-bipyridin-6-amine
Database identifiers
PubChem CID
59596002
Properties
Computed structural properties
XLogP
2.2
Topological polar surface area
97.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
286
Show all 8
Show all 8 / 8
Related reactions
6 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
93596
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
163040
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
813571
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
HRID
2264177
As product
uspto-grants-2010_12
HRID
2264178
As reactant
uspto-grants-2010_12
HRID
2264195
As reactant
uspto-grants-2010_12
Show 2 more
Compound notes
Loading…