| CAS Number | 562080-91-5 |
| Catalog Number | AG00DG8S(AGN-PC-0L9FYW) |
| Chemical Name | 4-BROMO-2-IODOACETANILDE |
| IUPAC Name | N-(4-bromo-2-iodophenyl)acetamide |
| InChI | InChI=1S/C8H7BrINO/c1-5(12)11-8-3-2-6(9)4-7(8)10/h2-4H,1H3,(H,11,12) |
| InChI Key | CKKIHKFIJOFIHZ-UHFFFAOYSA-N |
| MDL Number | MFCD02673646 |
| Molecular Formula | C8H7BrINO |
| Molecular Weight | 339.9557 |
| SMILES | BrC1=CC(=C(C=C1)NC(C)=O)I |
| Synonyms | N-(4-bromo-2-iodophenyl)acetamide,
562080-91-5,
AC1N86K0,
SCHEMBL5597892,
4-BROMO-2-IODOACETANILDE,
ZINC408706,
N-(2-Iodo-4-bromophenyl)acetamide,
MFCD02673646,
AKOS004006763,
MCULE-1827690532,
AM804826,
CS-0038148,
N-(4-bromo-2-iodo-phenyl)acetamide,
CID4339008,
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| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 338.876g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 339.958g/mol |
| Monoisotopic Mass | 338.876g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number