| CAS Number | 1841379-64-3 |
| Catalog Number | AG01DZ48 |
| Chemical Name | (3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol |
| IUPAC Name | (3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol |
| InChI | InChI=1S/C6H13NO2/c1-7-3-6(9)2-5(7)4-8/h5-6,8-9H,2-4H2,1H3/t5-,6-/m0/s1 |
| InChI Key | IXFHJDFJPFHQLP-WDSKDSINSA-N |
| MDL Number | MFCD31667610 |
| Molecular Formula | C6H13NO2 |
| Molecular Weight | 131.1729 |
| SMILES | CN1[C@H](CO)C[C@H](O)C1 |
| Synonyms | SCHEMBL8313622,
(3S,5S)-5-(hydroxymethyl)-1-methylpyrrolidin-3-ol,
1841379-64-3,
|
| Complexity | 97.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.175g/mol |
| Monoisotopic Mass | 131.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
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Certificate of Analysis
Lot Number