Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-3-(trifluoromethyl)-, hydrochloride
Basic information
- CAS
131961-47-2- Standard SMILES
CN(C)CCOCC(O)c1cccc(C(F)(F)F)c1.Cl- InChIKey
LOWSUYDTPKAWJR-UHFFFAOYSA-N- Molecular formula
- C13H19ClF3NO2
- Average molar mass
- 313.74 g/mol
- Monoisotopic mass
- 313.105641
Names & identifiers
- Preferred name
- Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-3-(trifluoromethyl)-, hydrochloride
- IUPAC
- 2-[2-(dimethylamino)ethoxy]-1-[3-(trifluoromethyl)phenyl]ethanol;hydrochloride
Names & synonyms
alpha-((2-(Dimethylamino)ethoxy)methyl)-3-(trifluoromethyl)benzenemethanol hydrochloride131961-47-2Benzenemethanol, alpha-((2-(dimethylamino)ethoxy)methyl)-3-(trifluoromethyl)-, hydrochlorideRefChem:325003SCHEMBL8484477DTXSID00927440LOWSUYDTPKAWJR-UHFFFAOYSA-N2-[2-(Dimethylamino)ethoxy]-1-[3-(trifluoromethyl)phenyl]ethan-1-ol--hydrogen chloride (1/1)
Database identifiers
- CAS
131961-47-2- PubChem CID
- 3076583
- DTXSID
DTXSID00927440
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 259
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Related reactions
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Compound notes
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