| CAS Number | 1094651-50-9 |
| Catalog Number | AG008SW5(AGN-PC-0WNODE) |
| Chemical Name | 1-Bromo-3-(chloromethyl)-5-fluorobenzene |
| IUPAC Name | 1-bromo-3-(chloromethyl)-5-fluorobenzene |
| InChI | InChI=1S/C7H5BrClF/c8-6-1-5(4-9)2-7(10)3-6/h1-3H,4H2 |
| InChI Key | QNVSLUFLTUOQNT-UHFFFAOYSA-N |
| MDL Number | MFCD11619429 |
| Molecular Formula | C7H5BrClF |
| Molecular Weight | 223.4700 |
| SMILES | FC1=CC(CCl)=CC(Br)=C1 |
| Synonyms | 3-BROMO-5-FLUOROBENZYL CHLORIDE,
1094651-50-9,
1-BROMO-3-(CHLOROMETHYL)-5-FLUOROBENZENE,
SCHEMBL4059894,
DTXSID30655784,
MFCD11619429,
ZINC57403683,
AKOS009396981,
AB64454,
AS00636,
PS-10661,
AB0034024,
X8112,
C7H5BrClF,
3-Bromo-5-fluorobenzal chloride,
1000339-58-1,
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| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.469g/mol |
| Monoisotopic Mass | 221.925g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number