| CAS Number | 40630-40-8 |
| Catalog Number | AG01C5CB |
| Chemical Name | 1,1,1-Trifluoro-N-(2-Hydroxyethyl)Methanesulfonamide |
| IUPAC Name | 1,1,1-trifluoro-N-(2-hydroxyethyl)methanesulfonamide |
| InChI | InChI=1S/C3H6F3NO3S/c4-3(5,6)11(9,10)7-1-2-8/h7-8H,1-2H2 |
| InChI Key | ALZPKDUBPSBRMK-UHFFFAOYSA-N |
| MDL Number | MFCD12185396 |
| Molecular Formula | C3H6F3NO3S |
| Molecular Weight | 193.1448 |
| SMILES | O=S(C(F)(F)F)(NCCO)=O |
| Synonyms | 40630-40-8,
1,1,1-trifluoro-N-(2-hydroxyethyl)methanesulfonamide,
SCHEMBL606519,
ALZPKDUBPSBRMK-UHFFFAOYSA-N,
2-trifluoromethanesulfonamidoethanol,
ZINC35610692,
AKOS009531661,
2-[(trifluoromethyl)sulfonyl]aminoethanol,
N-(2-Hydroxyethyl)trifluoromethanesulfonamide,
2-(trifluoromethyl)sulfonylaminoethanol,
ACN-041525,
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| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.002g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.14g/mol |
| Monoisotopic Mass | 193.002g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 74.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number