| CAS Number | 98404-02-5 |
| Catalog Number | AG00IK2S(AGN-PC-01Z0V3) |
| Chemical Name | 4-Chloro-2-fluoro-5-nitrophenol |
| IUPAC Name | 4-chloro-2-fluoro-5-nitrophenol |
| InChI | InChI=1S/C6H3ClFNO3/c7-3-1-4(8)6(10)2-5(3)9(11)12/h1-2,10H |
| InChI Key | DIIWMWNVGLVEFJ-UHFFFAOYSA-N |
| MDL Number | MFCD23110976 |
| Molecular Formula | C6H3ClFNO3 |
| Molecular Weight | 191.5443 |
| SMILES | OC1=CC([N+]([O-])=O)=C(Cl)C=C1F |
| Synonyms | 4-chloro-2-fluoro-5-nitrophenol,
98404-02-5,
SCHEMBL4875401,
ZINC59685133,
AKOS027302834,
FCH3494358,
PC501177,
FT-0754354,
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| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.542g/mol |
| Monoisotopic Mass | 190.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 66A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number