LU 3-011
Basic information
- CAS
13088-02-3- Standard SMILES
CN(C)CC/C=C1/c2ccccc2C(C)(C)c2ccc(C(F)(F)F)cc21.Cl- InChIKey
WSABIMDRSAVSKO-LFMIJCLESA-N- Molecular formula
- C22H25ClF3N
- Average molar mass
- 395.9 g/mol
- Monoisotopic mass
- 395.162762
Names & identifiers
- Preferred name
- LU 3-011
- IUPAC
- (3Z)-3-[10,10-dimethyl-2-(trifluoromethyl)anthracen-9-ylidene]-N,N-dimethylpropan-1-amine;hydrochloride
Names & synonyms
LU 3-01113088-02-3RefChem:1088570delta(sup 9 (10H)),gamma-Anthracenepropylamine, N,N,10,10-tetramethyl-7-(trifluoromethyl)-, hydrochloride
Database identifiers
- CAS
13088-02-3- PubChem CID
- 6437809
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 520
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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