| CAS Number | 5213-17-2 |
| Catalog Number | AG01EWCA(AGN-PC-00MB6J) |
| Chemical Name | 4-Fluoro-2-methoxybenzoyl chloride |
| IUPAC Name | 4-fluoro-2-methoxybenzoyl chloride |
| InChI | InChI=1S/C8H6ClFO2/c1-12-7-4-5(10)2-3-6(7)8(9)11/h2-4H,1H3 |
| InChI Key | KOHPYCKBINGPFW-UHFFFAOYSA-N |
| MDL Number | MFCD07772787 |
| Molecular Formula | C8H6ClFO2 |
| Molecular Weight | 188.5834 |
| SMILES | c1c(cc(c(c1)C(=O)Cl)OC)F |
| Synonyms | 4-Fluoro-2-methoxybenzoyl chloride,
5213-17-2,
4-Fluoro-o-anisoyl chloride,
SCHEMBL2336567,
KOHPYCKBINGPFW-UHFFFAOYSA-N,
2-methoxy-4-fluorobenzoyl chloride,
JRD-1710,
FCH856505,
ZINC36533188,
AKOS006286352,
PC408256,
1214377-19-1,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.582g/mol |
| Monoisotopic Mass | 188.004g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number