Basic information
- CAS
41067-34-9- Standard SMILES
NC(=O)CC[n+]1cc2ccccc2cn1.[Cl-]- InChIKey
WTFYKIFJQYTTNX-UHFFFAOYSA-N- Molecular formula
- C11H12ClN3O
- Average molar mass
- 237.68 g/mol
- Monoisotopic mass
- 237.0668897
Names & identifiers
- Preferred name
- 2-(3-Amino-3-oxopropyl)phthalazin-2-ium chloride
- IUPAC
- 3-phthalazin-2-ium-2-ylpropanamide chloride
Names & synonyms
41067-34-92-(3-Amino-3-oxopropyl)phthalazin-2-ium chlorideDTXSID00785648
Database identifiers
- CAS
41067-34-9- PubChem CID
- 71362005
- DTXSID
DTXSID00785648
Properties
Computed structural properties
- Topological polar surface area
- 59.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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