| CAS Number | 2060050-68-0 |
| Catalog Number | AG01B69F |
| Chemical Name | 1-azabicyclo[3.2.1]octan-5-ylmethanesulfonyl chloride hydrochloride |
| IUPAC Name | 1-azabicyclo[3.2.1]octan-5-ylmethanesulfonyl chloride;hydrochloride |
| InChI | InChI=1S/C8H14ClNO2S.ClH/c9-13(11,12)7-8-2-1-4-10(6-8)5-3-8;/h1-7H2;1H |
| InChI Key | WJBAVVCTLFTVEV-UHFFFAOYSA-N |
| MDL Number | MFCD30497504 |
| Molecular Formula | C8H15Cl2NO2S |
| Molecular Weight | 260.1812 |
| SMILES | Cl.ClS(CC12CCCN(C1)CC2)(=O)=O |
| Synonyms | 2060050-68-0,
1-azabicyclo[3.2.1]octan-5-ylmethanesulfonyl chloride hydrochloride,
{1-azabicyclo[3.2.1]octan-5-yl}methanesulfonyl chloride hydrochloride,
|
| Complexity | 298 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.02g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.173g/mol |
| Monoisotopic Mass | 259.02g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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