Basic information
- CAS
1750-07-8- Standard SMILES
C[NH2+]CCCC1c2ccccc2CCc2ccccc21.[Cl-]- InChIKey
LXRLABSDZUKVGP-UHFFFAOYSA-N- Molecular formula
- C19H24ClN
- Average molar mass
- 301.9 g/mol
- Monoisotopic mass
- 301.1597275
Names & identifiers
- Preferred name
- LU 3-063
- IUPAC
- methyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)propyl]azanium chloride
Names & synonyms
5H-Dibenzo(a,d)cycloheptene-5-propylamine, 10,11-dihydro-N-methyl-, hydrochlorideLU 3-0631750-07-810,11-Dihydro-5-(3-methylaminopropyl)-5H-dibenzo(a,d)cycloheptene hydrochloride5H-Dibenzo(a,d)cycloheptene, 10,11-dihydro-5-(3-methylaminopropyl)-, hydrochlorideDTXSID90169918RefChem:351416DTXCID0092409methyl-[3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)propyl]azanium;chloride
Database identifiers
- CAS
1750-07-8- PubChem CID
- 15633
Properties
Computed structural properties
- Topological polar surface area
- 16.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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