| CAS Number | 1421602-81-4 |
| Catalog Number | AG01A16H(AGN-PC-0WOCI8) |
| Chemical Name | 2,4-dibromo-6-fluoropyridin-3-ol; trifluoroacetic acid |
| IUPAC Name | 2,4-dibromo-6-fluoropyridin-3-ol;2,2,2-trifluoroacetic acid |
| InChI | InChI=1S/C5H2Br2FNO.C2HF3O2/c6-2-1-3(8)9-5(7)4(2)10;3-2(4,5)1(6)7/h1,10H;(H,6,7) |
| InChI Key | IQYNVZHRCXDFIA-UHFFFAOYSA-N |
| MDL Number | MFCD22392189 |
| Molecular Formula | C7H3Br2F4NO3 |
| Molecular Weight | 384.9052 |
| SMILES | OC(C(F)(F)F)=O.OC1=C(Br)N=C(F)C=C1Br |
| Synonyms | 2,4-dibromo-6-fluoropyridin-3-ol; trifluoroacetic acid,
1421602-81-4,
2,4-dibromo-6-fluoropyridin-3-ol, trifluoroacetic acid,
AKOS026730118,
MCULE-9301933661,
NE56335,
Z1695906904,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 384.84g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 384.907g/mol |
| Monoisotopic Mass | 382.842g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 70.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number