| CAS Number | 740737-56-8 |
| Catalog Number | AG01ADKW |
| Chemical Name | Ethyl 2-(methylamino)-3-phenylpropanoate |
| IUPAC Name | ethyl 2-(methylamino)-3-phenylpropanoate |
| InChI | InChI=1S/C12H17NO2/c1-3-15-12(14)11(13-2)9-10-7-5-4-6-8-10/h4-8,11,13H,3,9H2,1-2H3 |
| InChI Key | YFCBBIWXYBRHCL-UHFFFAOYSA-N |
| MDL Number | MFCD12151079 |
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.2689 |
| SMILES | CCOC(C(NC)CC1=CC=CC=C1)=O |
| Synonyms | ethyl 2-(methylamino)-3-phenylpropanoate,
740737-56-8,
SCHEMBL4765072,
MCULE-6467346085,
NE22613,
|
| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.273g/mol |
| Monoisotopic Mass | 207.126g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number