Basic information
- CAS
18801-36-0- Standard SMILES
C[NH+](C)CCOC12CCC(c3ccccc31)c1cccc(Cl)c12.[Cl-]- InChIKey
VPDBLBIQUCJSHI-UHFFFAOYSA-N- Molecular formula
- C20H23Cl2NO
- Average molar mass
- 364.3 g/mol
- Monoisotopic mass
- 363.1156697
Names & identifiers
- Preferred name
- Ethylamine, 2-(1-chloro-9,10-ethanoanthracen-9(10H)-yloxy)-N,N-dimethyl-, hydrochloride
- IUPAC
- 2-[(3-chloro-1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2(7),3,5,9,11,13-hexaenyl)oxy]ethyl-dimethylazanium chloride
Names & synonyms
Ethylamine, 2-(1-chloro-9,10-ethanoanthracen-9(10H)-yloxy)-N,N-dimethyl-, hydrochloride9,10-Dihydro-1-chloro-9-(2-(dimethylamino)ethoxy)-9,10-ethanoanthracene hydrochloride9,10-Ethanoanthracene, 9,10-dihydro-1-chloro-9-(2-(dimethylamino)ethoxy)-, hydrochloride18801-36-0RefChem:345112
Database identifiers
- CAS
18801-36-0- PubChem CID
- 29261
Properties
Computed structural properties
- Topological polar surface area
- 13.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 428
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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