| CAS Number | 1332839-78-7 |
| Catalog Number | AG01BKDA(AGN-PC-0WCJR9) |
| Chemical Name | 3-(2-Fluorophenyl)oxetan-3-amine hydrochloride |
| IUPAC Name | 3-(2-fluorophenyl)oxetan-3-amine;hydrochloride |
| InChI | InChI=1S/C9H10FNO.ClH/c10-8-4-2-1-3-7(8)9(11)5-12-6-9;/h1-4H,5-6,11H2;1H |
| InChI Key | HPEXYLYWHONDCK-UHFFFAOYSA-N |
| MDL Number | MFCD20386185 |
| Molecular Formula | C9H11ClFNO |
| Molecular Weight | 203.6411 |
| SMILES | Cl.NC1(C2=C(F)C=CC=C2)COC1 |
| Synonyms | 3-(2-Fluorophenyl)oxetan-3-amine hydrochloride,
1332839-78-7,
3-Amino-3-(2-fluorophenyl)oxetane hydrochloride,
ZX-AP009590,
KS-6832,
PC49494,
3-(2-fluorophenyl)oxetan-3-amine;hydrochloride,
2-(3-Aminooxetan-3-yl)fluorobenzene hydrochloride,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.05132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.64g/mol |
| Monoisotopic Mass | 203.05132g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number