5-(Trifluoroacetamido)pyridine-2-sulfonyl chloride
Basic information
- CAS
1215906-69-6- Standard SMILES
O=C(Nc1ccc(S(=O)(=O)Cl)nc1)C(F)(F)F- InChIKey
QBEPUMYJPSFUNN-UHFFFAOYSA-N- Molecular formula
- C7H4ClF3N2O3S
- Average molar mass
- 288.63 g/mol
- Monoisotopic mass
- 287.9583253
Names & identifiers
- Preferred name
- 5-(Trifluoroacetamido)pyridine-2-sulfonyl chloride
- IUPAC
- 5-[(2,2,2-trifluoroacetyl)amino]pyridine-2-sulfonyl chloride
Names & synonyms
5-(trifluoroacetamido)pyridine-2-sulfonyl chloride1215906-69-6RefChem:531717823-854-35-[(2,2,2-trifluoroacetyl)amino]pyridine-2-sulfonyl chloride5-(2,2,2-trifluoroacetamido)pyridine-2-sulfonyl chlorideGS29345-(trifluoroacetamido)pyridine-2-sulfonylchlorideEN300-1717400
Database identifiers
- CAS
1215906-69-6- PubChem CID
- 82055441
- EC Number
- 823-854-3
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 392
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
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, 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.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
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Related reactions
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Compound notes
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