Basic information
- Standard SMILES
COC(=O)c1cc(Cl)ncc1[N+](=O)[O-]- InChIKey
SBGNWCJYDUUYTN-UHFFFAOYSA-N- Molecular formula
- C7H5ClN2O4
- Average molar mass
- 216.58 g/mol
Names & identifiers
- Preferred name
- Methyl 2-chloro-5-nitroisonicotinate
- IUPAC
- methyl 2-chloro-5-nitropyridine-4-carboxylate
Names & synonyms
methyl 2-chloro-5-nitroisonicotinate777899-57-72-Chloro-5-nitro-isonicotinic acid methyl esterMFCD19105213methyl 2-chloro-5-nitropyridine-4-carboxylateMethyl 2-chloro-5-nitro-pyridine-4-carboxylateSCHEMBL1092975SCHEMBL14621948SCHEMBL29828356SBGNWCJYDUUYTN-UHFFFAOYSA-Nmethyl2-chloro-5-nitroisonicotinateAKOS022689927
Show more names
BS-17538DA-41377SY322742CS-0162471F534046
Database identifiers
- PubChem CID
- 45480451
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 242
Related reactions
6 records
Compound notes
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