| CAS Number | 1201149-19-0 |
| Catalog Number | AG000QC5(AGN-PC-0CRKQ7) |
| Chemical Name | Benzenamine, 4-bromo-2-fluoro-6-iodo- |
| IUPAC Name | 4-bromo-2-fluoro-6-iodoaniline |
| InChI | InChI=1S/C6H4BrFIN/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,10H2 |
| InChI Key | BEVNAVSJFOFMKX-UHFFFAOYSA-N |
| MDL Number | MFCD22570400 |
| Molecular Formula | C6H4BrFIN |
| Molecular Weight | 315.9095 |
| SMILES | BrC1=CC(=C(N)C(=C1)I)F |
| Synonyms | 4-bromo-2-fluoro-6-iodoaniline,
1201149-19-0,
SCHEMBL406756,
BEVNAVSJFOFMKX-UHFFFAOYSA-N,
MFCD22570400,
AKOS026730759,
ZINC113758724,
(4-bromo-2-fluoro-6-iodophenyl)amine,
Benzenamine, 4-bromo-2-fluoro-6-iodo-,
AS-35535,
SY246217,
MFCD22570400 (95%),
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| Complexity | 124 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 314.856g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 315.912g/mol |
| Monoisotopic Mass | 314.856g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number