Basic information
- CAS
66147-38-4- Standard SMILES
O=C(O)CCCCCc1ccc(Nc2c3ccccc3[nH+]c3ccccc23)cc1.[Cl-]- InChIKey
YAVSBLOQAJTDGP-UHFFFAOYSA-N- Molecular formula
- C25H25ClN2O2
- Average molar mass
- 420.9 g/mol
- Monoisotopic mass
- 420.1604557
Names & identifiers
- Preferred name
- Hexanoic acid, 6-(p-(9-acridinylamino)phenyl)-, hydrochloride
- IUPAC
- 6-[4-(acridin-10-ium-9-ylamino)phenyl]hexanoic acid chloride
Names & synonyms
6-(p-(9-Acridinylamino)phenyl)hexanoic acid, hydrochloride66147-38-4HEXANOIC ACID, 6-(p-(9-ACRIDINYLAMINO)PHENYL)-, HYDROCHLORIDERefChem:347719
Database identifiers
- CAS
66147-38-4- PubChem CID
- 47822
Properties
Computed structural properties
- Topological polar surface area
- 63.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 495
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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