1,1,1-Trifluoro-5-phenylpentan-3-amine
Basic information
- CAS
1249080-46-3- Standard SMILES
NC(CCc1ccccc1)CC(F)(F)F- InChIKey
FYACPZGCLYNRKN-UHFFFAOYSA-N- Molecular formula
- C11H14F3N
- Average molar mass
- 217.23 g/mol
- Monoisotopic mass
- 217.10783394
Names & identifiers
- Preferred name
- 1,1,1-Trifluoro-5-phenylpentan-3-amine
- IUPAC
- 1,1,1-trifluoro-5-phenylpentan-3-amine
Names & synonyms
1,1,1-trifluoro-5-phenylpentan-3-amine1249080-46-3RefChem:409482959-051-0AKOS010651857EN300-342674
Database identifiers
- CAS
1249080-46-3- PubChem CID
- 61392609
- EC Number
- 959-051-0
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 173
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, 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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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