| CAS Number | 26378-18-7 |
| Catalog Number | AG01C6GX(AGN-PC-02IT8U) |
| Chemical Name | 2,4,6-Trichloro-3-methoxyphenol |
| IUPAC Name | 2,4,6-trichloro-3-methoxyphenol |
| InChI | InChI=1S/C7H5Cl3O2/c1-12-7-4(9)2-3(8)6(11)5(7)10/h2,11H,1H3 |
| InChI Key | CKMBXEUDRVYVLB-UHFFFAOYSA-N |
| MDL Number | MFCD29991509 |
| Molecular Formula | C7H5Cl3O2 |
| Molecular Weight | 227.4724 |
| SMILES | COC1=C(Cl)C(O)=C(Cl)C=C1Cl |
| Synonyms | 2,4,6-trichloro-3-methoxyphenol,
26378-18-7,
SCHEMBL7788686,
ZINC14769778,
|
| Complexity | 156 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.936g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.465g/mol |
| Monoisotopic Mass | 225.936g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number