(2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-amine hydrochloride
Basic information
- CAS
336105-51-2- Standard SMILES
CC(C)(C)[C@H](N)C(F)(F)F.Cl- InChIKey
MXGSFTNYUNYRLZ-WCCKRBBISA-N- Molecular formula
- C6H13ClF3N
- Average molar mass
- 191.62 g/mol
- Monoisotopic mass
- 191.0688616
Names & identifiers
- Preferred name
- (2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-amine hydrochloride
- IUPAC
- (2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-amine;hydrochloride
- English name
- (2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-amine:hydrochloride
- Molecular formula
- C6H13ClF3N
- Molecular weight
- 191.6223296
Names & synonyms
(2S)-1,1,1-TRIFLUORO-3,3-DIMETHYLBUTAN-2-AMINE HYDROCHLORIDERefChem:3977102-Butanamine, 1,1,1-trifluoro-3,3-dimethyl-, hydrochloride (1:1), (2S)-889-948-1336105-51-2(S)-2,2-Dimethyl-1-trifluoromethyl-propylamine hydrochloride(S)-1,1,1-trifluoro-3,3-dimethylbutan-2-amine hydrochloride(2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-amine;hydrochloride(S)-2,2-Dimethyl-1-trifluoromethyl-propylaminehydrochlorideSCHEMBL20531826WLZ4429MXGSFTNYUNYRLZ-WCCKRBBISA-N
Show more names
(2S)-1,1,1-trifluoro-3,3-dimethylbutan-2-amine:hydrochloride
AT14754CS-0217552EN300-7718373F093849(S)-1,1,1-TRIFLUORO-3,3-DIMETHYLBUTAN-2-AMINE HCL(2S)-1,1,1-trifluoro-3,3-dimethyl-butan-2-amine;hydrochloride
Database identifiers
- CAS
336105-51-2- PubChem CID
- 66570533
- EC Number
- 889-948-1
Properties
Computed structural properties
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 111
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H302-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H302-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P
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Compound notes
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