| CAS Number | 1804881-28-4 |
| Catalog Number | AG01FR2C(AGN-PC-3H5PEG) |
| Chemical Name | 1-Chloro-5-fluoro-4-methoxy-2-methyl-benzene |
| IUPAC Name | 1-chloro-5-fluoro-4-methoxy-2-methylbenzene |
| InChI | InChI=1S/C8H8ClFO/c1-5-3-8(11-2)7(10)4-6(5)9/h3-4H,1-2H3 |
| InChI Key | CIECHYIUEISONX-UHFFFAOYSA-N |
| MDL Number | MFCD28751740 |
| Molecular Formula | C8H8ClFO |
| Molecular Weight | 174.5999 |
| SMILES | COc1cc(C)c(cc1F)Cl |
| Synonyms | 1804881-28-4,
SCHEMBL17086577,
4-Chloro-2-fluoro-5-methylanisole,
1-Chloro-5-fluoro-4-methoxy-2-methyl-benzene,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.024771g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.6g/mol |
| Monoisotopic Mass | 174.024771g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number