Basic information
- Standard SMILES
CCP(=O)(O)c1cc(Oc2ncc(Cl)cc2Cl)ccc1[N+](=O)[O-]- InChIKey
QDPHVIXUFVCWKJ-UHFFFAOYSA-N- Molecular formula
- C13H11Cl2N2O5P
- Average molar mass
- 377.11 g/mol
- Monoisotopic mass
- 375.9782638
Names & identifiers
- Preferred name
- P-ethyl-2-nitro-5-(3,5-dichloro-2-pyridyloxy)phenylphosphinic acid
- IUPAC
- [5-[(3,5-dichloro-2-pyridinyl)oxy]-2-nitrophenyl]-ethylphosphinic acid
Names & synonyms
SCHEMBL10855208QDPHVIXUFVCWKJ-UHFFFAOYSA-NP-ethyl-2-nitro-5-(3,5-dichloro-2-pyridyloxy)phenylphosphinic acidP-ethyl-2-nitro-5-(3,5-dichloro-2-pyridyloxy)phenyl-phosphinic acid
Database identifiers
- PubChem CID
- 20251602
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 478
Related reactions
4 records
Linked notes
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