| CAS Number | 1805502-21-9 |
| Catalog Number | AG01FGV8(AGN-PC-3H4AKP) |
| Chemical Name | 3-Bromo-6-fluorobenzene -1,2-diamine |
| IUPAC Name | 3-bromo-6-fluorobenzene-1,2-diamine |
| InChI | InChI=1S/C6H6BrFN2/c7-3-1-2-4(8)6(10)5(3)9/h1-2H,9-10H2 |
| InChI Key | SFORNKLUYLIFGZ-UHFFFAOYSA-N |
| MDL Number | MFCD28154969 |
| Molecular Formula | C6H6BrFN2 |
| Molecular Weight | 205.0276 |
| SMILES | NC1=C(F)C=CC(Br)=C1N |
| Synonyms | 1-Bromo-2,3-diamino-4-fluorobenzene,
1805502-21-9,
SCHEMBL19000144,
MFCD28154969,
ZINC169797823,
FCH2907031,
3-Bromo-6-fluorobenzene -1,2-diamine,
PC501049,
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| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.03g/mol |
| Monoisotopic Mass | 203.97g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number