Basic information
- CAS
56795-20-1- Standard SMILES
CC(C)(C)[NH2+]CC(O)c1ccc(N)c(F)c1.[Cl-]- InChIKey
ZTOJVVBTYKAIKQ-UHFFFAOYSA-N- Molecular formula
- C12H20ClFN2O
- Average molar mass
- 262.75 g/mol
- Monoisotopic mass
- 262.1248191
Names & identifiers
- Preferred name
- Benzyl alcohol, 4-amino-alpha-((tert-butylamino)methyl)-3-fluoro-, hydrochloride
- IUPAC
- [2-(4-amino-3-fluorophenyl)-2-hydroxyethyl]-tert-butylazanium chloride
Names & synonyms
56795-20-1BENZYL ALCOHOL, 4-AMINO-alpha-((tert-BUTYLAMINO)METHYL)-3-FLUORO-, HYDROCHLORIDERefChem:10794334-Amino-alpha-((tert-butylamino)methyl)-3-fluorobenzyl alcohol hydrochlorideBenzenemethanol, 4-amino-alpha-(((1,1-dimethylethyl)amino)methyl)-3-fluoro-, hydrochloride
Database identifiers
- CAS
56795-20-1- PubChem CID
- 41996
Properties
Computed structural properties
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 218
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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