| CAS Number | 72372-71-5 |
| Catalog Number | AG0036R6(AGN-PC-009YNA) |
| Chemical Name | 1-Hexanesulfonic acid, 6-amino- |
| IUPAC Name | 6-aminohexane-1-sulfonic acid |
| InChI | InChI=1S/C6H15NO3S/c7-5-3-1-2-4-6-11(8,9)10/h1-7H2,(H,8,9,10) |
| InChI Key | KIDCLLZBQFQFAZ-UHFFFAOYSA-N |
| MDL Number | MFCD20693449 |
| Molecular Formula | C6H15NO3S |
| Molecular Weight | 181.2532 |
| SMILES | NCCCCCCS(=O)(=O)O |
| Synonyms | 6-amino-1-hexanesulfonic acid,
72372-71-5,
1-Hexanesulfonic acid, 6-amino-,
SCHEMBL513056,
CTK2H2547,
DTXSID90467204,
MFCD20693449,
6-aminohexane-1-sulfonic Acid,
CID11480823,
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| Complexity | 171 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.25g/mol |
| Monoisotopic Mass | 181.077g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 88.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -2.7 |
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Certificate of Analysis
Lot Number