| CAS Number | 1208076-74-7 |
| Catalog Number | AG01BKK5 |
| Chemical Name | 2-fluoro-5-methylbenzene-1-thiol |
| IUPAC Name | 2-fluoro-5-methylbenzenethiol |
| InChI | InChI=1S/C7H7FS/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3 |
| InChI Key | UWNWVKXVJLZBPH-UHFFFAOYSA-N |
| MDL Number | MFCD12026166 |
| Molecular Formula | C7H7FS |
| Molecular Weight | 142.1939 |
| SMILES | CC1=CC(S)=C(F)C=C1 |
| Synonyms | 2-Fluoro-5-methylbenzenethiol,
1208076-74-7,
SCHEMBL9194254,
ZINC36533035,
AKOS006316670,
|
| Complexity | 94.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.02525g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.2g/mol |
| Monoisotopic Mass | 142.02525g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number