(5-(Trifluoromethyl)pyridin-3-yl)methanamine dihydrochloride
Basic information
- CAS
1332529-79-9- Standard SMILES
Cl.Cl.NCc1cncc(C(F)(F)F)c1- InChIKey
XRJFAOSMGPIFLC-UHFFFAOYSA-N- Molecular formula
- C7H9Cl2F3N2
- Average molar mass
- 249.06 g/mol
- Monoisotopic mass
- 248.0094882
Names & identifiers
- Preferred name
- (5-(Trifluoromethyl)pyridin-3-yl)methanamine dihydrochloride
- IUPAC
- [5-(trifluoromethyl)-3-pyridinyl]methanamine;dihydrochloride
- English name
- C-(5-Trifluoromethyl-pyridin-3-yl)-methylaminedihydrochloride
- Molecular formula
- C7H9Cl2F3N2
- Molecular weight
- 249.06
Names & synonyms
(5-(Trifluoromethyl)pyridin-3-yl)methanamine dihydrochloride[5-(trifluoromethyl)pyridin-3-yl]methanamine dihydrochloride3-Pyridinemethanamine, 5-(trifluoromethyl)-, hydrochloride (1:2)RefChem:403712100-950-71332529-79-9c-(5-Trifluoromethyl-pyridin-3-yl)-methylaminedihydrochloride[5-(trifluoromethyl)pyridin-3-yl]methanamine;dihydrochloride3-(Aminomethyl)-5-(trifluoromethyl)pyridine dihydrochlorideC-(5-Trifluoromethyl-pyridin-3-yl)-methylamine dihydrochlorideMFCD16988625SCHEMBL4456204
Show more names
(5-(Trifluoromethyl)pyridin-3-yl)methanamine hydrochloride
[5-(Trifluoromethyl)pyridin-3-yl]methylamine dihydrochlorideHDC52979VQB74792AKOS007930451MS-20257DB-097303EN300-761723G30454
Database identifiers
- CAS
1332529-79-9- PubChem CID
- 56587776
- EC Number
- 100-950-7
Properties
Computed structural properties
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 146
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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