Basic information
- CAS
15930-96-8- Standard SMILES
Cc1ccc2c(c1)/C(=C/CCN(C)C)c1ccccc1S2.Cl- InChIKey
BGJJJYAGBNULBN-TWNLEINFSA-N- Molecular formula
- C19H22ClNS
- Average molar mass
- 331.9 g/mol
- Monoisotopic mass
- 331.1161486
Names & identifiers
- Preferred name
- Thioxanthene-delta(sup 9,gamma)-propylamine, N,N,2-trimethyl-, hydrochloride, (E)-
- IUPAC
- (3E)-N,N-dimethyl-3-(2-methylthioxanthen-9-ylidene)propan-1-amine;hydrochloride
Names & synonyms
trans-2-Methyl-9-(3-dimethylaminopropylidene)thioxanthene hydrochloride(E)-N,N,2-Trimethylthioxanthene-delta(sup 9,gamma)-propylamine hydrochlorideThioxanthene-delta(sup 9,gamma)-propylamine, N,N,2-trimethyl-, hydrochloride, (E)-15930-96-8DTXSID90166629RefChem:385575DTXCID7089120(3E)-N,N-Dimethyl-3-(2-methyl-9H-thioxanthen-9-ylidene)propan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
15930-96-8- PubChem CID
- 6444705
- DTXSID
DTXSID90166629
Properties
Computed structural properties
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…