1-[(3-Chlorophenoxy)methyl]-1H-pyrazol-3-amine
Basic information
- CAS
1006495-07-3- Standard SMILES
Nc1ccn(COc2cccc(Cl)c2)n1- InChIKey
RIVXILNYXFOULQ-UHFFFAOYSA-N- Molecular formula
- C10H10ClN3O
- Average molar mass
- 223.66 g/mol
- Monoisotopic mass
- 223.0512396
Names & identifiers
- Preferred name
- 1-[(3-Chlorophenoxy)methyl]-1H-pyrazol-3-amine
- IUPAC
- 1-[(3-chlorophenoxy)methyl]pyrazol-3-amine
Names & synonyms
1-[(3-CHLOROPHENOXY)METHYL]-1H-PYRAZOL-3-AMINEDTXSID101249111AKOS0003061371006495-07-3
Database identifiers
- CAS
1006495-07-3- PubChem CID
- 19618293
- DTXSID
DTXSID101249111
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…