| CAS Number | 431885-12-0 |
| Catalog Number | AG006ZB5(AGN-PC-0WB4NK) |
| Chemical Name | 2-(2-chlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide |
| IUPAC Name | 2-(2-chlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide |
| InChI | InChI=1S/C15H13ClINO2/c1-10-8-11(17)6-7-13(10)18-15(19)9-20-14-5-3-2-4-12(14)16/h2-8H,9H2,1H3,(H,18,19) |
| InChI Key | COHQNEUBKKNOGY-UHFFFAOYSA-N |
| MDL Number | MFCD03140190 |
| Molecular Formula | C15H13ClINO2 |
| Molecular Weight | 401.6267 |
| SMILES | N(C(COC1C=CC=CC=1Cl)=O)C1C=CC(=CC=1C)I |
| Synonyms | 2-(2-chlorophenoxy)-N-(4-iodo-2-methylphenyl)acetamide,
431885-12-0,
AC1LP8VH,
Cambridge id 6672118,
Oprea1_417973,
CTK4I7146,
DTXSID80361727,
CHEMBRDG-BB 6672118,
ZINC1159016,
MFCD03140190,
STK120254,
AKOS000368134,
MCULE-8539608203,
AJ-25071,
Y-0115,
AB00115351-01,
ZINC01159016,
CID1328022,
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| Complexity | 329 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 400.968g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 401.628g/mol |
| Monoisotopic Mass | 400.968g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number