| CAS Number | 62918-78-9 |
| Catalog Number | AG00IB3Z(AGN-PC-02MPDS) |
| Chemical Name | 3-Chloro-5-fluoro-4-methoxyaniline |
| IUPAC Name | 3-chloro-5-fluoro-4-methoxyaniline |
| InChI | InChI=1S/C7H7ClFNO/c1-11-7-5(8)2-4(10)3-6(7)9/h2-3H,10H2,1H3 |
| InChI Key | OUELVPNQPLAKHJ-UHFFFAOYSA-N |
| MDL Number | MFCD09832236 |
| Molecular Formula | C7H7ClFNO |
| Molecular Weight | 175.5880 |
| SMILES | COC1=C(Cl)C=C(N)C=C1F |
| Synonyms | 3-CHLORO-5-FLUORO-4-METHOXYANILINE,
62918-78-9,
SCHEMBL19922066,
CTK6J4314,
FCH873775,
MFCD09832236,
SBB089095,
ZINC38529567,
AKOS006328946,
JS-4362,
5-chloro-3-fluoro-4-methoxyphenylamine,
PC302292,
3-?Chloro-?5-?fluoro-?4-?methoxybenzenamine,
|
| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.587g/mol |
| Monoisotopic Mass | 175.02g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number