Basic information
- CAS
2649047-21-0- Standard SMILES
CN1CCN=C1C(N)C1CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F- InChIKey
VSLGURXWFNBFFA-UHFFFAOYSA-N- Molecular formula
- C12H17F6N3O4
- Average molar mass
- 381.27 g/mol
- Monoisotopic mass
- 381.112325
Names & identifiers
- Preferred name
- cyclopropyl(1-methyl-4,5-dihydro-1H-imidazol-2-yl)methanamine; bis(trifluoroacetic acid)
- IUPAC
- cyclopropyl-(1-methyl-4,5-dihydroimidazol-2-yl)methanamine;bis(2,2,2-trifluoroacetic acid)
Names & synonyms
2649047-21-0cyclopropyl(1-methyl-4,5-dihydro-1H-imidazol-2-yl)methanamine; bis(trifluoroacetic acid)RefChem:581207975-464-9cyclopropyl(1-methyl-4,5-dihydro-1H-imidazol-2-yl)methanamine,bis(trifluoroaceticacid)EN300-1725631Z3270287191
Database identifiers
- CAS
2649047-21-0- PubChem CID
- 137964591
- EC Number
- 975-464-9
Properties
Computed structural properties
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 267
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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