| CAS Number | 1807237-81-5 |
| Catalog Number | AG01FR2G(AGN-PC-3H5PEB) |
| Chemical Name | 4-Chloro-2-fluoro-5-methyl-phenol |
| IUPAC Name | 4-chloro-2-fluoro-5-methylphenol |
| InChI | InChI=1S/C7H6ClFO/c1-4-2-7(10)6(9)3-5(4)8/h2-3,10H,1H3 |
| InChI Key | QCNVUJFQFFZMLN-UHFFFAOYSA-N |
| MDL Number | MFCD28752137 |
| Molecular Formula | C7H6ClFO |
| Molecular Weight | 160.5733 |
| SMILES | CC1=C(Cl)C=C(F)C(O)=C1 |
| Synonyms | 4-Chloro-2-fluoro-5-methylphenol,
1807237-81-5,
SCHEMBL18617511,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 160.009121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 160.57g/mol |
| Monoisotopic Mass | 160.009121g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number