| CAS Number | 926237-17-4 |
| Catalog Number | AG01AINP |
| Chemical Name | 1-[4-(difluoromethoxy)phenyl]ethan-1-ol |
| IUPAC Name | 1-[4-(difluoromethoxy)phenyl]ethanol |
| InChI | InChI=1S/C9H10F2O2/c1-6(12)7-2-4-8(5-3-7)13-9(10)11/h2-6,9,12H,1H3 |
| InChI Key | RGSDDQLZKOJWLR-UHFFFAOYSA-N |
| MDL Number | MFCD08442290 |
| Molecular Formula | C9H10F2O2 |
| Molecular Weight | 188.1713 |
| SMILES | CC(C1=CC=C(OC(F)F)C=C1)O |
| Synonyms | 1-[4-(difluoromethoxy)phenyl]ethan-1-ol,
1-[4-(DIFLUOROMETHOXY)PHENYL]ETHANOL,
926237-17-4,
1-(4-(difluoromethoxy)phenyl)ethanol,
SCHEMBL18290854,
CTK7B7337,
AKOS000125371,
AKOS016899454,
MCULE-2509036640,
NE13820,
EN300-78473,
|
| Complexity | 145 |
| 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 | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
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