5-Cyclopropoxy-2-fluoroisonicotinic acid
Basic information
- CAS
1243461-13-3- Standard SMILES
O=C(O)c1cc(F)ncc1OC1CC1- InChIKey
RTTDDLOJYDLYCS-UHFFFAOYSA-N- Molecular formula
- C9H8FNO3
- Average molar mass
- 197.16 g/mol
- Monoisotopic mass
- 197.04882128
Names & identifiers
- Preferred name
- 5-Cyclopropoxy-2-fluoroisonicotinic acid
- IUPAC
- 5-cyclopropyloxy-2-fluoropyridine-4-carboxylic acid
Names & synonyms
5-CYCLOPROPOXY-2-FLUOROISONICOTINIC ACID1243461-13-3DTXSID001214808MB685405-(Cyclopropyloxy)-2-fluoro-4-pyridinecarboxylic acid5-(Cyclopropyloxy)-2-fluoropyridine-4-carboxylic acid
Database identifiers
- CAS
1243461-13-3- PubChem CID
- 72233249
- DTXSID
DTXSID001214808
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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