| CAS Number | 1807939-36-1 |
| Catalog Number | AG01BAT7 |
| Chemical Name | (1s,3s)-3-(3,5-difluorophenyl)cyclobutan-1-ol |
| IUPAC Name | 3-(3,5-difluorophenyl)cyclobutan-1-ol |
| InChI | InChI=1S/C10H10F2O/c11-8-1-6(2-9(12)5-8)7-3-10(13)4-7/h1-2,5,7,10,13H,3-4H2 |
| InChI Key | QMFASIJNNHUHHD-UHFFFAOYSA-N |
| MDL Number | MFCD28397739 |
| Molecular Formula | C10H10F2O |
| Molecular Weight | 184.1826 |
| SMILES | O[C@@H]1C[C@H](C2=CC(F)=CC(F)=C2)C1 |
| Synonyms | 3-(3,5-difluorophenyl)cyclobutan-1-ol,
1519955-82-8,
SCHEMBL19951673,
ZINC87283690,
AKOS018768597,
ZINC238855103,
3-(3,5-difluorophenyl)cyclobutan-1-ol, cis,
EN300-210867,
1807939-36-1,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.186g/mol |
| Monoisotopic Mass | 184.07g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number