| CAS Number | 83642-03-9 |
| Catalog Number | AG01FGH7(AGN-PC-03N09T) |
| Chemical Name | 1-(Bromomethyl)-4-(4-fluorophenoxy)benzene |
| IUPAC Name | 1-(bromomethyl)-4-(4-fluorophenoxy)benzene |
| InChI | InChI=1S/C13H10BrFO/c14-9-10-1-5-12(6-2-10)16-13-7-3-11(15)4-8-13/h1-8H,9H2 |
| InChI Key | OHSPHQZETPMLQY-UHFFFAOYSA-N |
| MDL Number | MFCD15146807 |
| Molecular Formula | C13H10BrFO |
| Molecular Weight | 281.1203 |
| SMILES | C1=CC(=CC=C1CBr)OC2=CC=C(C=C2)F |
| Synonyms | 1-(Bromomethyl)-4-(4-fluorophenoxy)benzene,
83642-03-9,
4-(4-Fluorophenoxy)benzyl bromide,
SCHEMBL6336359,
OHSPHQZETPMLQY-UHFFFAOYSA-N,
ZX-AP009422,
MFCD15146807,
ZINC71790012,
AS-8725,
PC10711,
4-(Bromomethyl)-4'-fluorodiphenyl ether,
1-(4-Fluorophenoxy)-4-(bromomethyl)benzene,
1-[4-(bromomethyl)phenoxy]-4-fluorobenzene,
Benzene, 1-(bromomethyl)-4-(4-fluorophenoxy)-,
Benzene,1-(bromomethyl)-4-(4-fluorophenoxy)-,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.124g/mol |
| Monoisotopic Mass | 279.99g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number