| CAS Number | 2055840-65-6 |
| Catalog Number | AG002A7B(AGN-PC-0WNH9C) |
| Chemical Name | 2-Azabicyclo[2.2.1]heptane, 6,6-difluoro-, hydrochloride (1:1) |
| IUPAC Name | 6,6-difluoro-2-azabicyclo[2.2.1]heptane;hydrochloride |
| InChI | InChI=1S/C6H9F2N.ClH/c7-6(8)2-4-1-5(6)9-3-4;/h4-5,9H,1-3H2;1H |
| InChI Key | NTGJGSSRQVJJEJ-UHFFFAOYSA-N |
| MDL Number | MFCD28992107 |
| Molecular Formula | C6H10ClF2N |
| Molecular Weight | 169.6001 |
| SMILES | Cl.FC1(C2CC(CN2)C1)F |
| Synonyms | 6,6-Difluoro-2-azabicyclo[2.2.1]heptane hydrochloride,
6,6-DIFLUORO-2-AZABICYCLO[2.2.1]HEPTANE HCL,
2055840-65-6,
KS-000008UF,
MFCD28992107,
AKOS030630892,
AS-53514,
CS-0050372,
6,6-Difluoro-2-aza-bicyclo[2.2.1]heptane hydrochloride,
na,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.6g/mol |
| Monoisotopic Mass | 169.047g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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