2,2-dichloro-N-pyren-1-ylacetamide
Basic information
- Standard SMILES
O=C(Nc1ccc2ccc3cccc4ccc1c2c34)C(Cl)Cl- InChIKey
JCQBDBPTTHSFCI-UHFFFAOYSA-N- Molecular formula
- C18H11Cl2NO
- Average molar mass
- 328.2 g/mol
- Monoisotopic mass
- 327.0217694
Names & identifiers
- Preferred name
- 2,2-dichloro-N-pyren-1-ylacetamide
- IUPAC
- 2,2-dichloro-N-pyren-1-ylacetamide
Names & synonyms
NSC81343NCIOpen2_009053SCHEMBL28667363NSC-81343
Database identifiers
- PubChem CID
- 255654
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 441
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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