| CAS Number | 1312454-79-7 |
| Catalog Number | AG01BB50 |
| Chemical Name | tert-Butyl 2-(aminomethyl)-2-methylpyrrolidine-1-carboxylate |
| IUPAC Name | tert-butyl 2-(aminomethyl)-2-methylpyrrolidine-1-carboxylate |
| InChI | InChI=1S/C11H22N2O2/c1-10(2,3)15-9(14)13-7-5-6-11(13,4)8-12/h5-8,12H2,1-4H3 |
| InChI Key | KTQQDWACAUDUJC-UHFFFAOYSA-N |
| MDL Number | MFCD22038178 |
| Molecular Formula | C11H22N2O2 |
| Molecular Weight | 214.3046 |
| SMILES | NCC1(N(CCC1)C(=O)OC(C)(C)C)C |
| Synonyms | tert-butyl 2-(aminomethyl)-2-methylpyrrolidine-1-carboxylate,
1312454-79-7,
SCHEMBL6922182,
KTQQDWACAUDUJC-UHFFFAOYSA-N,
tert-butyl (2R)-2-(aminomethyl)-2-methylpyrrolidine-1-carboxylate,
tert-butyl (2S)-2-(aminomethyl)-2-methylpyrrolidine-1-carboxylate,
1407997-78-7,
1408057-41-9,
|
| Complexity | 248 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.309g/mol |
| Monoisotopic Mass | 214.168g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number