| CAS Number | 1192347-87-7 |
| Catalog Number | AG01FGZH(AGN-PC-3H4ALC) |
| Chemical Name | (4-Fluoro-3-methanesulfonylphenyl)methanol |
| IUPAC Name | (4-fluoro-3-methylsulfonylphenyl)methanol |
| InChI | InChI=1S/C8H9FO3S/c1-13(11,12)8-4-6(5-10)2-3-7(8)9/h2-4,10H,5H2,1H3 |
| InChI Key | CWRDDRJVAVOIKJ-UHFFFAOYSA-N |
| MDL Number | MFCD26051381 |
| Molecular Formula | C8H9FO3S |
| Molecular Weight | 204.2187 |
| SMILES | OCc1ccc(c(c1)S(=O)(=O)C)F |
| Synonyms | 4-Fluoro-3-(methylsulfonyl)benzyl alcohol,
1192347-87-7,
SCHEMBL1017319,
CWRDDRJVAVOIKJ-UHFFFAOYSA-N,
MFCD26051381,
ZINC115042074,
(4-fluoro-3-methanesulfonylphenyl)methanol,
[4-fluoro-3-(methylsulfonyl)phenyl]methanol,
4-fluoro-3-(methylsulfonyl)Benzenemethanol,
|
| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 204.215g/mol |
| Monoisotopic Mass | 204.026g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 62.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number