| CAS Number | 949892-08-4 |
| Catalog Number | AG0066W6(AGN-PC-0WNQIQ) |
| Chemical Name | 1-Bromo-5-chloro-4-fluoro-2-methoxybenzene |
| IUPAC Name | 1-bromo-5-chloro-4-fluoro-2-methoxybenzene |
| InChI | InChI=1S/C7H5BrClFO/c1-11-7-3-6(10)5(9)2-4(7)8/h2-3H,1H3 |
| InChI Key | NVSMLSKXNOHPFW-UHFFFAOYSA-N |
| MDL Number | MFCD18783171 |
| Molecular Formula | C7H5BrClFO |
| Molecular Weight | 239.4694 |
| SMILES | COC1=C(Br)C=C(Cl)C(F)=C1 |
| Synonyms | 1-Bromo-5-chloro-4-fluoro-2-methoxybenzene,
949892-08-4,
SCHEMBL4148256,
CTK8B7100,
DTXSID10682194,
NVSMLSKXNOHPFW-UHFFFAOYSA-N,
2-Bromo-4-chloro-5-fluoroanisole,
ANW-56362,
MFCD18783171,
ZINC65337452,
AKOS015888492,
AJ-115162,
TC-145107,
ST24021277,
V9492,
A-3387,
I01-10724,
C7H5BrClFO,
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| Complexity | 136 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.92g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.468g/mol |
| Monoisotopic Mass | 237.92g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number