| CAS Number | 2044713-13-3 |
| Catalog Number | AG01BXGT |
| Chemical Name | 1-(4-fluorophenyl)-2-azaspiro[3.3]heptane hydrochloride |
| IUPAC Name | 3-(4-fluorophenyl)-2-azaspiro[3.3]heptane;hydrochloride |
| InChI | InChI=1S/C12H14FN.ClH/c13-10-4-2-9(3-5-10)11-12(8-14-11)6-1-7-12;/h2-5,11,14H,1,6-8H2;1H |
| InChI Key | BQKFTVZZXNLMQD-UHFFFAOYSA-N |
| MDL Number | MFCD30487798 |
| Molecular Formula | C12H15ClFN |
| Molecular Weight | 227.7056 |
| SMILES | Cl.FC1=CC=C(C2C3(CCC3)CN2)C=C1 |
| Synonyms | 1-(4-fluorophenyl)-2-azaspiro[3.3]heptane hydrochloride,
2044713-13-3,
|
| Complexity | 216 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.707g/mol |
| Monoisotopic Mass | 227.088g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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