5-[(2-Chlorophenyl)hydrazinylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Basic information
- CAS
81077-43-2- Standard SMILES
CC1(C)OC(=O)C(=NNc2ccccc2Cl)C(=O)O1- InChIKey
LOIXKPKJCKVTLA-UHFFFAOYSA-N- Molecular formula
- C12H11ClN2O4
- Average molar mass
- 282.68 g/mol
- Monoisotopic mass
- 282.0407345
Names & identifiers
- Preferred name
- 5-[(2-Chlorophenyl)hydrazinylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
- IUPAC
- 5-[(2-chlorophenyl)hydrazinylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Names & synonyms
81077-43-2NSC3587515-[(2-chlorophenyl)hydrazinylidene]-2,2-dimethyl-1,3-dioxane-4,6-dioneDTXSID60320377NSC-3587515-[2-(2-Chlorophenyl)hydrazinylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Database identifiers
- CAS
81077-43-2- PubChem CID
- 338047
- DTXSID
DTXSID60320377
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 400
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Related reactions
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Compound notes
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