| CAS Number | 1508278-50-9 |
| Catalog Number | AG00ABRO(AGN-PC-0WCK1U) |
| Chemical Name | Ethyl 2-((4-chloro-5-iodo-2-methoxyphenyl)amino)acetate |
| IUPAC Name | ethyl 2-(4-chloro-5-iodo-2-methoxyanilino)acetate |
| InChI | InChI=1S/C11H13ClINO3/c1-3-17-11(15)6-14-9-5-8(13)7(12)4-10(9)16-2/h4-5,14H,3,6H2,1-2H3 |
| InChI Key | IAGREPMOCBHTAS-UHFFFAOYSA-N |
| MDL Number | MFCD27978472 |
| Molecular Formula | C11H13ClINO3 |
| Molecular Weight | 369.5833 |
| SMILES | CCOC(=O)CNc1cc(I)c(Cl)cc1OC |
| Synonyms | Ethyl 2-((4-chloro-5-iodo-2-methoxyphenyl)amino)acetate,
1508278-50-9,
SCHEMBL16122825,
IAGREPMOCBHTAS-UHFFFAOYSA-N,
CS-B0994,
MFCD27978472,
ZINC97756590,
Ethyl 2-(4-chloro-5-iodo-2-methoxyphenylamino)acetate,
Glycine, N-(4-chloro-5-iodo-2-methoxyphenyl)-, ethyl ester,
|
| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 368.963g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 369.583g/mol |
| Monoisotopic Mass | 368.963g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number