| CAS Number | 1158201-88-7 |
| Catalog Number | AG019W5U(AGN-PC-0WOR3V) |
| Chemical Name | 2-(piperazine-1-sulfonyl)ethan-1-amine dihydrochloride |
| IUPAC Name | 2-piperazin-1-ylsulfonylethanamine;dihydrochloride |
| InChI | InChI=1S/C6H15N3O2S.2ClH/c7-1-6-12(10,11)9-4-2-8-3-5-9;;/h8H,1-7H2;2*1H |
| InChI Key | BMIPOXFILZDTEC-UHFFFAOYSA-N |
| MDL Number | MFCD12912878 |
| Molecular Formula | C6H17Cl2N3O2S |
| Molecular Weight | 266.1891 |
| SMILES | Cl.Cl.NCCS(N1CCNCC1)(=O)=O |
| Synonyms | 2-(piperazine-1-sulfonyl)ethan-1-amine dihydrochloride,
1158201-88-7,
2-(Piperazin-1-ylsulfonyl)ethan-1-amine dihydrochloride,
AC1Q3AVU,
CTK7E9247,
AKOS008110421,
MCULE-5308988845,
NE21573,
EN300-50629,
|
| Complexity | 215 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.181g/mol |
| Monoisotopic Mass | 265.042g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 83.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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