| CAS Number | 1037298-05-7 |
| Catalog Number | AG003AEZ(AGN-PC-0D5OQ1) |
| Chemical Name | 3-bromo-4-iodophenol |
| IUPAC Name | 3-bromo-4-iodophenol |
| InChI | InChI=1S/C6H4BrIO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H |
| InChI Key | GHYOKMYZWDAXJW-UHFFFAOYSA-N |
| MDL Number | MFCD17000017 |
| Molecular Formula | C6H4BrIO |
| Molecular Weight | 298.9038 |
| SMILES | BrC=1C=C(C=CC1I)O |
| Synonyms | 3-BROMO-4-IODOPHENOL,
1037298-05-7,
3-Bromo-4-iodo-phenol,
SCHEMBL13978630,
MFCD17000017,
ZINC88190131,
AKOS027323604,
MB26105,
NE31922,
PS-11920,
SC-52276,
AS-813/43501593,
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| Complexity | 99.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.849g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.905g/mol |
| Monoisotopic Mass | 297.849g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number