| CAS Number | 1334164-87-2 |
| Catalog Number | AG009X3Y(AGN-PC-0WNQZB) |
| Chemical Name | 2-Fluoro-3-(trifluoromethoxy)phenol |
| IUPAC Name | 2-fluoro-3-(trifluoromethoxy)phenol |
| InChI | InChI=1S/C7H4F4O2/c8-6-4(12)2-1-3-5(6)13-7(9,10)11/h1-3,12H |
| InChI Key | KMWGGTMNTDIDSL-UHFFFAOYSA-N |
| MDL Number | MFCD22208493 |
| Molecular Formula | C7H4F4O2 |
| Molecular Weight | 196.0991 |
| SMILES | FC(Oc1cccc(c1F)O)(F)F |
| Synonyms | 2-fluoro-3-(trifluoromethoxy)phenol,
1334164-87-2,
SCHEMBL2092732,
ZINC72190245,
Z9698,
K-4189,
C7H4F4O2,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.101g/mol |
| Monoisotopic Mass | 196.015g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number