| CAS Number | 1118788-30-9 |
| Catalog Number | AG019UK0(AGN-PC-0WOBFT) |
| Chemical Name | tert-butyl 4-[(chlorosulfonyl)(methyl)amino]piperidine-1-carboxylate |
| IUPAC Name | tert-butyl 4-[chlorosulfonyl(methyl)amino]piperidine-1-carboxylate |
| InChI | InChI=1S/C11H21ClN2O4S/c1-11(2,3)18-10(15)14-7-5-9(6-8-14)13(4)19(12,16)17/h9H,5-8H2,1-4H3 |
| InChI Key | WEGPMCVWYUNTLW-UHFFFAOYSA-N |
| MDL Number | MFCD11857858 |
| Molecular Formula | C11H21ClN2O4S |
| Molecular Weight | 312.8134 |
| SMILES | CN(S(Cl)(=O)=O)C1CCN(C(OC(C)(C)C)=O)CC1 |
| Synonyms | tert-butyl 4-[(chlorosulfonyl)(methyl)amino]piperidine-1-carboxylate,
1118788-30-9,
AC1Q3X86,
CTK6I1302,
ZINC59530754,
AKOS026729753,
NE34714,
EN300-41904,
|
| Complexity | 419 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 312.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 312.809g/mol |
| Monoisotopic Mass | 312.091g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 75.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number