Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-3-fluoro-, hydrochloride
Basic information
- CAS
131961-13-2- Standard SMILES
CN(C)CCOCC(O)c1cccc(F)c1.Cl- InChIKey
BWMGZHIYMLOHBA-UHFFFAOYSA-N- Molecular formula
- C12H19ClFNO2
- Average molar mass
- 263.73 g/mol
- Monoisotopic mass
- 263.1088347
Names & identifiers
- Preferred name
- Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-3-fluoro-, hydrochloride
- IUPAC
- 2-[2-(dimethylamino)ethoxy]-1-(3-fluorophenyl)ethanol;hydrochloride
Names & synonyms
2-(2-(N,N-Dimethylamino)ethoxy)-1-(3-fluorophenyl)ethanol hydrochloride131961-13-2alpha-((2-(Dimethylamino)ethoxy)methyl)-3-fluorobenzenemethanol hydrochlorideBenzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-3-fluoro-, hydrochlorideRefChem:325004SCHEMBL8478515DTXSID109274312-[2-(Dimethylamino)ethoxy]-1-(3-fluorophenyl)ethan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
131961-13-2- PubChem CID
- 3076565
- DTXSID
DTXSID10927431
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 190
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