| CAS Number | 773868-63-6 |
| Catalog Number | AG01AIZU |
| Chemical Name | [5-chloro-2-(difluoromethoxy)phenyl]methanol |
| IUPAC Name | [5-chloro-2-(difluoromethoxy)phenyl]methanol |
| InChI | InChI=1S/C8H7ClF2O2/c9-6-1-2-7(13-8(10)11)5(3-6)4-12/h1-3,8,12H,4H2 |
| InChI Key | WRCKBMKBPHCJSS-UHFFFAOYSA-N |
| MDL Number | MFCD06202710 |
| Molecular Formula | C8H7ClF2O2 |
| Molecular Weight | 208.5898 |
| SMILES | ClC=1C=CC(=C(C1)CO)OC(F)F |
| Synonyms | [5-chloro-2-(difluoromethoxy)phenyl]methanol,
773868-63-6,
SCHEMBL16954085,
ZINC36895041,
AKOS009310198,
MCULE-2778312863,
NE23365,
EN300-79440,
Z1250208668,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.589g/mol |
| Monoisotopic Mass | 208.01g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
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