5-Amino-2-(trifluoromethyl)bicyclo[2.2.1]heptan-2-ol hydrochloride
Basic information
- CAS
2287331-48-8- Standard SMILES
Cl.NC1CC2CC1CC2(O)C(F)(F)F- InChIKey
XVUHQFBTWQKYEN-UHFFFAOYSA-N- Molecular formula
- C8H13ClF3NO
- Average molar mass
- 231.64 g/mol
- Monoisotopic mass
- 231.0637762
Names & identifiers
- Preferred name
- 5-Amino-2-(trifluoromethyl)bicyclo[2.2.1]heptan-2-ol hydrochloride
- IUPAC
- 5-amino-2-(trifluoromethyl)bicyclo[2.2.1]heptan-2-ol;hydrochloride
Names & synonyms
2287331-48-85-amino-2-(trifluoromethyl)bicyclo[2.2.1]heptan-2-ol hydrochloride5-amino-2-(trifluoromethyl)bicyclo(2.2.1)heptan-2-ol hydrochlorideRefChem:532134839-620-95-Amino-2-(trifluoromethyl)bicyclo[2.2.1]heptan-2-ol;hydrochlorideEN300-67400645-amino-2-(trifluoromethyl)bicyclo[2.2.1]heptan-2-olhydrochloride,Mixtureofdiastereomers
Database identifiers
- CAS
2287331-48-8- PubChem CID
- 137944707
- EC Number
- 839-620-9
Properties
Computed structural properties
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 230
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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