| CAS Number | 695188-21-7 |
| Catalog Number | AG00FGV9(AGN-PC-03SREH) |
| Chemical Name | 4-Bromo-3-fluorobenzoyl chloride |
| IUPAC Name | 4-bromo-3-fluorobenzoyl chloride |
| InChI | InChI=1S/C7H3BrClFO/c8-5-2-1-4(7(9)11)3-6(5)10/h1-3H |
| InChI Key | QKNNWDFHKRIYJH-UHFFFAOYSA-N |
| MDL Number | MFCD09746051 |
| Molecular Formula | C7H3BrClFO |
| Molecular Weight | 237.4535 |
| SMILES | FC1=C(Br)C=CC(C(Cl)=O)=C1 |
| Synonyms | 4-Bromo-3-fluorobenzoyl chloride,
695188-21-7,
SCHEMBL321581,
CTK6G5406,
3-fluoro-4-bromobenzoyl chloride,
DTXSID50627069,
QKNNWDFHKRIYJH-UHFFFAOYSA-N,
4-bromo-3-fluoro-benzoyl chloride,
BBL103975,
MFCD09746051,
SBB098831,
STL557785,
ZINC16159639,
Benzoyl chloride, 4-bromo-3-fluoro-,
AKOS010970918,
RP05762,
AS-40424,
SC-39392,
X2860,
J-514722,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.904g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.452g/mol |
| Monoisotopic Mass | 235.904g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number