3-(3-Chlorophenyl)-5-(3-nitrophenyl)-1H-pyrazole
Basic information
- CAS
143704-43-2- Standard SMILES
O=[N+]([O-])c1cccc(-c2cc(-c3cccc(Cl)c3)[nH]n2)c1- InChIKey
HSONWMFBECDANP-UHFFFAOYSA-N- Molecular formula
- C15H10ClN3O2
- Average molar mass
- 299.71 g/mol
- Monoisotopic mass
- 299.0461543
Names & identifiers
- Preferred name
- 3-(3-Chlorophenyl)-5-(3-nitrophenyl)-1H-pyrazole
- IUPAC
- 5-(3-chlorophenyl)-3-(3-nitrophenyl)-1H-pyrazole
Names & synonyms
143704-43-23-(3-Chlorophenyl)-5-(3-nitrophenyl)-1H-pyrazoleSCHEMBL15425119DTXSID30771519
Database identifiers
- CAS
143704-43-2- PubChem CID
- 136229487
- DTXSID
DTXSID30771519
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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