| CAS Number | 1394969-84-6 |
| Catalog Number | AG009X2L(AGN-PC-0WNWR2) |
| Chemical Name | 2,4-Dichloro-3,5-difluorophenol |
| IUPAC Name | 2,4-dichloro-3,5-difluorophenol |
| InChI | InChI=1S/C6H2Cl2F2O/c7-4-2(9)1-3(11)5(8)6(4)10/h1,11H |
| InChI Key | LWMLZSHNKKTXEP-UHFFFAOYSA-N |
| MDL Number | MFCD23111013 |
| Molecular Formula | C6H2Cl2F2O |
| Molecular Weight | 198.9823 |
| SMILES | Clc1c(O)cc(c(c1F)Cl)F |
| Synonyms | 2,4-Dichloro-3,5-difluorophenol,
1394969-84-6,
C6H2Cl2F2O,
SCHEMBL11712559,
MFCD23111013,
ZINC95944430,
V2976,
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| Complexity | 147 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.945g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.978g/mol |
| Monoisotopic Mass | 197.945g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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Certificate of Analysis
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