| CAS Number | 922719-77-5 |
| Catalog Number | AG00IH2B(AGN-PC-0WCYL0) |
| Chemical Name | 1-(Benzyloxy)-4-(bromomethyl)-2-fluorobenzene |
| IUPAC Name | 4-(bromomethyl)-2-fluoro-1-phenylmethoxybenzene |
| InChI | InChI=1S/C14H12BrFO/c15-9-12-6-7-14(13(16)8-12)17-10-11-4-2-1-3-5-11/h1-8H,9-10H2 |
| InChI Key | YCHITSDJFZQYMX-UHFFFAOYSA-N |
| MDL Number | MFCD12405688 |
| Molecular Formula | C14H12BrFO |
| Molecular Weight | 295.1469 |
| SMILES | FC1=CC(CBr)=CC=C1OCC1=CC=CC=C1 |
| Synonyms | 1-(BENZYLOXY)-4-(BROMOMETHYL)-2-FLUOROBENZENE,
922719-77-5,
SCHEMBL3777246,
3-Fluoro-4-benzyloxybenzyl bromide,
MFCD12405688,
ZINC66054697,
AKOS025296425,
AS-35639,
X-3165,
4-(bromomethyl)-2-fluoro-1-phenylmethoxybenzene,
(4-(4-pyridyloxy)phenyl)sulfonyl chloride hydrochloride,
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| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 294.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.151g/mol |
| Monoisotopic Mass | 294.006g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
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Certificate of Analysis
Lot Number