| CAS Number | 869493-53-8 |
| Catalog Number | AG0188ZF(AGN-PC-3H4H46) |
| Chemical Name | 3-(4,4-Difluoro-piperidin-1-yl)-propylamine |
| IUPAC Name | 3-(4,4-difluoropiperidin-1-yl)propan-1-amine |
| InChI | InChI=1S/C8H16F2N2/c9-8(10)2-6-12(7-3-8)5-1-4-11/h1-7,11H2 |
| InChI Key | QFGAZHYAXWTEQI-UHFFFAOYSA-N |
| MDL Number | MFCD13184097 |
| Molecular Formula | C8H16F2N2 |
| Molecular Weight | 178.2228 |
| SMILES | NCCCN1CCC(F)(F)CC1 |
| Synonyms | 869493-53-8,
3-(4,4-Difluoro-piperidin-1-yl)-propylamine,
3-(4,4-difluoropiperidin-1-yl)propan-1-amine,
SCHEMBL2206093,
DTXSID30735318,
ZINC85652803,
A1-02802,
F1908-0187,
|
| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.128g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.227g/mol |
| Monoisotopic Mass | 178.128g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number