Basic information
- Standard SMILES
Nc1ccc(Oc2nccnc2Cl)cc1- InChIKey
BVHKZMHLTUAREB-UHFFFAOYSA-N- Molecular formula
- C10H8ClN3O
- Average molar mass
- 221.64 g/mol
- Monoisotopic mass
- 221.0355896
Names & identifiers
- Preferred name
- 4-(3-Chloropyrazin-2-yloxy)benzenamine
- IUPAC
- 4-(3-chloropyrazin-2-yl)oxyaniline
Names & synonyms
4-(3-CHLOROPYRAZIN-2-YLOXY)BENZENAMINE105130-25-44-(3-chloropyrazin-2-yloxy)anilineSCHEMBL1304578BVHKZMHLTUAREB-UHFFFAOYSA-NDB-304996
Database identifiers
- PubChem CID
- 20133974
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 197
Related reactions
15 records
Compound notes
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