Basic information
- CAS
66147-36-2- Standard SMILES
O=C(O)CCCc1ccc(Nc2c3ccccc3[nH+]c3ccccc23)cc1.[Cl-]- InChIKey
NGOADTKISQPERO-UHFFFAOYSA-N- Molecular formula
- C23H21ClN2O2
- Average molar mass
- 392.9 g/mol
- Monoisotopic mass
- 392.1291556
Names & identifiers
- Preferred name
- Butyric acid, 4-(p-(9-acridinylamino)phenyl)-, hydrochloride
- IUPAC
- 4-[4-(acridin-10-ium-9-ylamino)phenyl]butanoic acid chloride
Names & synonyms
4-(p-(9-Acridinylamino)phenyl)butyric acid, hydrochloride66147-36-2BUTYRIC ACID, 4-(p-(9-ACRIDINYLAMINO)PHENYL)-, HYDROCHLORIDERefChem:331319
Database identifiers
- CAS
66147-36-2- PubChem CID
- 47820
Properties
Computed structural properties
- Topological polar surface area
- 63.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 467
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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