| CAS Number | 938-63-6 |
| Catalog Number | AG01A10O(AGN-PC-00K0OV) |
| Chemical Name | 4-Amino-2,3,5,6-tetrafluorophenol |
| IUPAC Name | 4-amino-2,3,5,6-tetrafluorophenol |
| InChI | InChI=1S/C6H3F4NO/c7-1-3(9)6(12)4(10)2(8)5(1)11/h12H,11H2 |
| InChI Key | FFRMSRDSTZTRKL-UHFFFAOYSA-N |
| MDL Number | MFCD02181029 |
| Molecular Formula | C6H3F4NO |
| Molecular Weight | 181.0877 |
| SMILES | OC1=C(F)C(F)=C(N)C(F)=C1F |
| Synonyms | 4-amino-2,3,5,6-tetrafluorophenol,
938-63-6,
SCHEMBL5513293,
2,3,5,6-tetrafluoro-4-aminophenol,
ZINC39335608,
AKOS033340251,
MCULE-5585803694,
NE33321,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.09g/mol |
| Monoisotopic Mass | 181.015g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number