| CAS Number | 1630907-35-5 |
| Catalog Number | AG003A8L(AGN-PC-0WCXE1) |
| Chemical Name | benzyl 3-(methylamino)azetidine-1-carboxylate |
| IUPAC Name | benzyl 3-(methylamino)azetidine-1-carboxylate |
| InChI | InChI=1S/C12H16N2O2/c1-13-11-7-14(8-11)12(15)16-9-10-5-3-2-4-6-10/h2-6,11,13H,7-9H2,1H3 |
| InChI Key | YKLRQIQMOPHXKS-UHFFFAOYSA-N |
| MDL Number | MFCD08703611 |
| Molecular Formula | C12H16N2O2 |
| Molecular Weight | 220.2676 |
| SMILES | CNC1CN(C(=O)OCc2ccccc2)C1 |
| Synonyms | benzyl 3-(methylamino)azetidine-1-carboxylate,
1630907-35-5,
MFCD08703611,
ZINC169804465,
FCH2820671,
SB21880,
KS-0000083S,
AK171820,
AS-50586,
CS-0049852,
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| Complexity | 233 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.272g/mol |
| Monoisotopic Mass | 220.121g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
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Certificate of Analysis
Lot Number