2-Fluoro-3-(trifluoromethoxy)benzylamine
Basic information
- CAS
1159512-65-8- Standard SMILES
NCc1cccc(OC(F)(F)F)c1F- InChIKey
LHGYLAHYSCRENL-UHFFFAOYSA-N- Molecular formula
- C8H7F4NO
- Average molar mass
- 209.14 g/mol
- Monoisotopic mass
- 209.0463765
Names & identifiers
- Preferred name
- 2-Fluoro-3-(trifluoromethoxy)benzylamine
- IUPAC
- [2-fluoro-3-(trifluoromethoxy)phenyl]methanamine
- English name
- 2-Fluoro-3-(trifluoromethoxy)benzylamine
- Molecular formula
- C8H7F4NO
- Molecular weight
- 209.14
Names & synonyms
2-Fluoro-3-(trifluoromethoxy)benzylamineRefChem:472220873-003-51159512-65-8MFCD12026479[2-fluoro-3-(trifluoromethoxy)phenyl]methanamine(2-Fluoro-3-(trifluoromethoxy)phenyl)methanamine[2-fluoro-3-(trifluoromethoxy)phenyl]methylamine1-[2-FLUORO-3-(TRIFLUOROMETHOXY)PHENYL]METHANAMINESCHEMBL4550818SCHEMBL30580173LHGYLAHYSCRENL-UHFFFAOYSA-N
Show more names
Benzenemethanamine, 2-fluoro-3-(trifluoromethoxy)-
DTXSID101241248SBB094155AKOS037655474PS-11367CS-04415462-Fluoro-3-(trifluoromethoxy)benzenemethanamine
Database identifiers
- CAS
1159512-65-8- PubChem CID
- 45933736
- DTXSID
DTXSID101241248- EC Number
- 873-003-5
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 185
Physicochemical properties
- form
- liquid
- color
- Clear, faint yellow
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314
- Precautionary statements
- 260 · P260-P280-P308+P313
- HS Code
- 2921490090 · 2921490090
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, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, 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.
Safety data
- hs_code
- 2921490090
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- Hazard statements
- H314
- Precautionary statements
- P260-P280-P308+P313
Suppliers
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Related reactions
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Compound notes
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