Basic information
- CAS
56340-16-0- Standard SMILES
CC(C)(C)[NH2+]CC(O)c1cc(F)c(N)c(I)c1.[Cl-]- InChIKey
FCWKPMXPBFEDCX-UHFFFAOYSA-N- Molecular formula
- C12H19ClFIN2O
- Average molar mass
- 388.65 g/mol
- Monoisotopic mass
- 388.02147
Names & identifiers
- Preferred name
- Benzyl alcohol, 4-amino-alpha-((tert-butylamino)methyl)-3-fluoro-5-iodo-, hydrochloride
- IUPAC
- [2-(4-amino-3-fluoro-5-iodophenyl)-2-hydroxyethyl]-tert-butylazanium chloride
Names & synonyms
Benzyl alcohol, 4-amino-alpha-((tert-butylamino)methyl)-3-fluoro-5-iodo-, hydrochloride56340-16-0RefChem:10794344-Amino-alpha-((tert-butylamino)methyl)-3-fluoro-5-iodobenzyl alcohol hydrochlorideBenzenemethanol, 4-amino-alpha-(((1,1-dimethylethyl)amino)methyl)-3-fluoro-5-iodo-, HCl
Database identifiers
- CAS
56340-16-0- PubChem CID
- 41845
Properties
Computed structural properties
- Topological polar surface area
- 62.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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