| CAS Number | 1127422-81-4 |
| Catalog Number | AG009434(AGN-PC-0WQVMN) |
| Chemical Name | 1-(2-bromo-5-hydroxyphenyl)ethanone |
| IUPAC Name | 1-(2-bromo-5-hydroxyphenyl)ethanone |
| InChI | InChI=1S/C8H7BrO2/c1-5(10)7-4-6(11)2-3-8(7)9/h2-4,11H,1H3 |
| InChI Key | ZZCFCXHCWBGEDV-UHFFFAOYSA-N |
| MDL Number | MFCD18452018 |
| Molecular Formula | C8H7BrO2 |
| Molecular Weight | 215.0440 |
| SMILES | C(=O)(C)c1c(Br)ccc(c1)O |
| Synonyms | 1-(2-BROMO-5-HYDROXYPHENYL)ETHANONE,
1127422-81-4,
SCHEMBL14978296,
2'-Bromo-5'-hydroxyacetophenone,
MFCD18452018,
ZINC72232945,
AKOS015969594,
1-(2-Bromo-5-hydroxyphenyl)ethan-1-one,
AM805886,
AS-39738,
CS-0036962,
FT-0704157,
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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 | 213.963g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.046g/mol |
| Monoisotopic Mass | 213.963g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number