Basic information
- CAS
62675-00-7- Standard SMILES
C[NH+](C)CCCC1=Cc2cc(Cl)ccc2Sc2ccccc21.[Cl-]- InChIKey
STNHOXQJEGBBOJ-UHFFFAOYSA-N- Molecular formula
- C19H21Cl2NS
- Average molar mass
- 366.3 g/mol
- Monoisotopic mass
- 365.0771762
Names & identifiers
- Preferred name
- Dibenzo(b,f)thiepin-10-propanamine, 2-chloro-N,N-dimethyl-, hydrochloride
- IUPAC
- 3-(3-chlorobenzo[b][1]benzothiepin-6-yl)propyl-dimethylazanium chloride
Names & synonyms
2-Chloro-10-(3-dimethylaminopropyl)dibenzo(b,f)thiepin hydrochloride62675-00-72-Chloro-N,N-dimethyldibenzo(b,f)thiepin-10-propanamine hydrochlorideDIBENZO(b,f)THIEPIN-10-PROPANAMINE, 2-CHLORO-N,N-DIMETHYL-, HYDROCHLORIDERefChem:337179
Database identifiers
- CAS
62675-00-7- PubChem CID
- 44134
Properties
Computed structural properties
- Topological polar surface area
- 29.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 395
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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