Basic information
- CAS
2754-55-4- Standard SMILES
C[NH+](C)CCCC1(O)c2ccccc2CCc2ccccc21.[Cl-]- InChIKey
XHURLEYPZGLDQG-UHFFFAOYSA-N- Molecular formula
- C20H26ClNO
- Average molar mass
- 331.9 g/mol
- Monoisotopic mass
- 331.1702921
Names & identifiers
- Preferred name
- 5H-Dibenzo(a,d)cyclohepten-5-ol, 10,11-dihydro-5-(3-(dimethylamino)propyl)-, monohydrochloride
- IUPAC
- 3-(2-hydroxy-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)propyl-dimethylazanium chloride
Names & synonyms
VUFB2794NSC 2696075-(3-(Dimethylamino)propyl)-10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ol hydrochloride5H-Dibenzo(a,d)cyclohepten-5-ol, 10,11-dihydro-5-(3-(dimethylamino)propyl)-, monohydrochloride2754-55-4RefChem:305526
Database identifiers
- CAS
2754-55-4- PubChem CID
- 17684
Properties
Computed structural properties
- Topological polar surface area
- 24.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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