| CAS Number | 1035390-48-7 |
| Catalog Number | AG007GF4(AGN-PC-0WAA4K) |
| Chemical Name | 4-Bromo-6-chloro-1,3-dihydro-2H-benzimidazol-2-one |
| IUPAC Name | 4-bromo-6-chlorobenzimidazol-2-one |
| InChI | InChI=1S/C7H2BrClN2O/c8-4-1-3(9)2-5-6(4)11-7(12)10-5/h1-2H |
| InChI Key | UYKXWFZVGDLZDS-UHFFFAOYSA-N |
| MDL Number | MFCD22123612 |
| Molecular Formula | C7H4BrClN2O |
| Molecular Weight | 247.4765 |
| SMILES | O=C1NC2=CC(Cl)=CC(Br)=C2N1 |
| Synonyms | 1035390-48-7,
4-Bromo-6-chloro-2H-benzo[d]imidazol-2-one,
4-BROMO-6-CHLOROBENZOIMIDAZOL-2-ONE,
C7H2BrClN2O,
CTK4A2175,
DTXSID30695600,
ACMC-209880,
ANW-14926,
ZINC65337121,
AKOS015835456,
4-Bromo-6-chloro-2H-benzimidazol-2-one,
AJ-115005,
AX8230734,
TR-033884,
Z6672,
I01-11067,
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| Complexity | 392 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.904g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.46g/mol |
| Monoisotopic Mass | 243.904g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number