| CAS Number | 651326-73-7 |
| Catalog Number | AG01C1Y0(AGN-PC-01NKU8) |
| Chemical Name | (6-bromo-2,3,4-trifluorophenyl)methanol |
| IUPAC Name | (6-bromo-2,3,4-trifluorophenyl)methanol |
| InChI | InChI=1S/C7H4BrF3O/c8-4-1-5(9)7(11)6(10)3(4)2-12/h1,12H,2H2 |
| InChI Key | BNIXKLPDUMIALR-UHFFFAOYSA-N |
| MDL Number | MFCD27926975 |
| Molecular Formula | C7H4BrF3O |
| Molecular Weight | 241.0053 |
| SMILES | OCC1=C(Br)C=C(F)C(F)=C1F |
| Synonyms | (6-Bromo-2,3,4-trifluorophenyl)methanol,
651326-73-7,
Benzenemethanol, 6-bromo-2,3,4-trifluoro-,
SCHEMBL5419727,
CTK1J9200,
DTXSID90591972,
ZINC75925991,
AKOS023126452,
Z2379087779,
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| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.007g/mol |
| Monoisotopic Mass | 239.94g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number