| CAS Number | 1260845-62-2 |
| Catalog Number | AG000RFL(AGN-PC-0WD6CB) |
| Chemical Name | 5-Chloro-1-fluoro-2-methoxy-3-nitrobenzene |
| IUPAC Name | 5-chloro-1-fluoro-2-methoxy-3-nitrobenzene |
| InChI | InChI=1S/C7H5ClFNO3/c1-13-7-5(9)2-4(8)3-6(7)10(11)12/h2-3H,1H3 |
| InChI Key | XOPIOMSLJVHTIO-UHFFFAOYSA-N |
| MDL Number | MFCD11847585 |
| Molecular Formula | C7H5ClFNO3 |
| Molecular Weight | 205.5709 |
| SMILES | COC1=C([N+]([O-])=O)C=C(Cl)C=C1F |
| Synonyms | 5-CHLORO-1-FLUORO-2-METHOXY-3-NITROBENZENE,
98404-03-6,
5-CHLORO-3-FLUORO-2-METHOXYNITROBENZENE,
1260845-62-2,
4-Chloro-2-fluoro-5-nitroanisole,
CTK6J4304,
MFCD11847585,
ZINC91252300,
CM11686,
SC-33679,
AJ-129224,
Benzene, 5-chloro-1-fluoro-2-methoxy-3-nitro-,
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| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.994g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.569g/mol |
| Monoisotopic Mass | 204.994g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number