| CAS Number | 1881328-14-8 |
| Catalog Number | AG00I2GS(AGN-PC-0WR8JG) |
| Chemical Name | 2,3-difluoro-4-(propan-2-yloxy)phenol |
| IUPAC Name | 2,3-difluoro-4-propan-2-yloxyphenol |
| InChI | InChI=1S/C9H10F2O2/c1-5(2)13-7-4-3-6(12)8(10)9(7)11/h3-5,12H,1-2H3 |
| InChI Key | VDWAMKTZLMDGDV-UHFFFAOYSA-N |
| MDL Number | MFCD29044513 |
| Molecular Formula | C9H10F2O2 |
| Molecular Weight | 188.1713 |
| SMILES | CC(Oc1ccc(c(c1F)F)O)C |
| Synonyms | 2,3-difluoro-4-(propan-2-yloxy)phenol,
1881328-14-8,
ZINC261494333,
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| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.174g/mol |
| Monoisotopic Mass | 188.065g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
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Certificate of Analysis
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