| CAS Number | 2060044-86-0 |
| Catalog Number | AG01BO7S |
| Chemical Name | 2-chloro-4-methoxy-3-methylaniline |
| IUPAC Name | 2-chloro-4-methoxy-3-methylaniline |
| InChI | InChI=1S/C8H10ClNO/c1-5-7(11-2)4-3-6(10)8(5)9/h3-4H,10H2,1-2H3 |
| InChI Key | KQLDYNCBJSQCRC-UHFFFAOYSA-N |
| MDL Number | MFCD30498813 |
| Molecular Formula | C8H10ClNO |
| Molecular Weight | 171.6241 |
| SMILES | COC1=C(C)C(Cl)=C(N)C=C1 |
| Synonyms | 2-chloro-4-methoxy-3-methylaniline,
2060044-86-0,
SCHEMBL19782792,
ZINC536953984,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.624g/mol |
| Monoisotopic Mass | 171.045g/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