| CAS Number | 1357353-59-3 |
| Catalog Number | AG00HUD9(AGN-PC-0WG3Z3) |
| Chemical Name | Methanesulfonic Acid 1-Propionyl-Piperidin-4-Ylmethyl Ester |
| IUPAC Name | (1-propanoylpiperidin-4-yl)methyl methanesulfonate |
| InChI | InChI=1S/C10H19NO4S/c1-3-10(12)11-6-4-9(5-7-11)8-15-16(2,13)14/h9H,3-8H2,1-2H3 |
| InChI Key | KGJFVQWLJUNOFV-UHFFFAOYSA-N |
| MDL Number | MFCD22209880 |
| Molecular Formula | C10H19NO4S |
| Molecular Weight | 249.3272 |
| SMILES | CCC(=O)N1CCC(COS(=O)(=O)C)CC1 |
| Synonyms | 1357353-59-3,
Methanesulfonic acid 1-propionyl-piperidin-4-ylmethyl ester,
(1-Propionylpiperidin-4-yl)methyl methanesulfonate,
MFCD22209880,
ZINC91304257,
AM805554,
AS-39797,
(1-propanoylpiperidin-4-yl)methyl methanesulfonate,
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| Complexity | 325 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 249.325g/mol |
| Monoisotopic Mass | 249.103g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 72.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number