Basic information
- CAS
102582-92-3- Standard SMILES
O=C(O)CS(=O)(=O)c1ccc(F)cc1.OCCN(CCO)CCO- InChIKey
WTTBAZUHLKDGJP-UHFFFAOYSA-N- Molecular formula
- C14H22FNO7S
- Average molar mass
- 367.39 g/mol
- Monoisotopic mass
- 367.11010138
Names & identifiers
- Preferred name
- Tris-(2-hydroxyethyl)ammonium 4-fluorophenylsulfonylacetate
- IUPAC
- 2-[bis(2-hydroxyethyl)amino]ethanol;2-(4-fluorophenyl)sulfonylacetic acid
Names & synonyms
Tris-(2-hydroxyethyl)ammonium 4-fluorophenylsulfonylacetate102582-92-34-fluorophenylsulfonylacetic acid tris(2-hydroxyethylammonium)FPS-THEARefChem:192152DTXCID4067779DTXSID00145288(p-Fluorophenylsulfonyl)acetic acid triethanolamine2-[bis(2-hydroxyethyl)amino]ethanol;2-(4-fluorophenyl)sulfonylacetic acidEthanol, 2,2',2''-nitrilotris-, ((4-fluorophenyl)sulfonyl)acetate (salt)
Database identifiers
- CAS
102582-92-3- PubChem CID
- 128124
Properties
Computed structural properties
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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