| CAS Number | 111043-49-3 |
| Catalog Number | AG01BHL4(AGN-PC-00O3JD) |
| Chemical Name | 1-[(4-fluorophenyl)methyl]azetidin-3-ol |
| IUPAC Name | 1-[(4-fluorophenyl)methyl]azetidin-3-ol |
| InChI | InChI=1S/C10H12FNO/c11-9-3-1-8(2-4-9)5-12-6-10(13)7-12/h1-4,10,13H,5-7H2 |
| InChI Key | JKNYOFXNAYHDJV-UHFFFAOYSA-N |
| MDL Number | MFCD12406961 |
| Molecular Formula | C10H12FNO |
| Molecular Weight | 181.2068 |
| SMILES | OC1CN(CC2=CC=C(F)C=C2)C1 |
| Synonyms | 1-[(4-fluorophenyl)methyl]azetidin-3-ol,
1-(4-fluorobenzyl)azetidin-3-ol,
111043-49-3,
SCHEMBL2922811,
JKNYOFXNAYHDJV-UHFFFAOYSA-N,
ZINC34161148,
AKOS012391714,
F8887-7451,
1-[(4-Fluorophenyl)methyl]-3-azetidinol,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.21g/mol |
| Monoisotopic Mass | 181.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number