| CAS Number | 102281-35-6 |
| Catalog Number | AG01C4N3 |
| Chemical Name | Ethyl 2-[benzyl(methyl)amino]propanoate |
| IUPAC Name | ethyl 2-[benzyl(methyl)amino]propanoate |
| InChI | InChI=1S/C13H19NO2/c1-4-16-13(15)11(2)14(3)10-12-8-6-5-7-9-12/h5-9,11H,4,10H2,1-3H3 |
| InChI Key | UVUIFQSYHWKBHE-UHFFFAOYSA-N |
| MDL Number | MFCD16089665 |
| Molecular Formula | C13H19NO2 |
| Molecular Weight | 221.2955 |
| SMILES | CCOC(C(N(CC1=CC=CC=C1)C)C)=O |
| Synonyms | ethyl 2-[benzyl(methyl)amino]propanoate,
102281-35-6,
AKOS010993599,
Z900208432,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.3g/mol |
| Monoisotopic Mass | 221.142g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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Certificate of Analysis
Lot Number