| CAS Number | 54608-35-4 |
| Catalog Number | AG01AHJO(AGN-PC-0NEQEY) |
| Chemical Name | Ethyl 2-[(2-phenylethyl)amino]acetate |
| IUPAC Name | ethyl 2-(2-phenylethylamino)acetate |
| InChI | InChI=1S/C12H17NO2/c1-2-15-12(14)10-13-9-8-11-6-4-3-5-7-11/h3-7,13H,2,8-10H2,1H3 |
| InChI Key | ADVKOLZYLWXQSH-UHFFFAOYSA-N |
| MDL Number | MFCD11152837 |
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.2689 |
| SMILES | CCOC(=O)CNCCC1=CC=CC=C1 |
| Synonyms | ethyl 2-[(2-phenylethyl)amino]acetate,
54608-35-4,
ethyl phenethylaminoacetate,
SCHEMBL7415640,
ADVKOLZYLWXQSH-UHFFFAOYSA-N,
MFCD11152837,
ZINC20050798,
AKOS000253963,
(Phenethylamino)acetic acid ethyl ester,
NE36800,
Glycine, N-(2-phenylethyl)-, ethyl ester,
FT-0749633,
EN300-74950,
Ethyl 2-(phenethylamino)acetate,
CID11031025,
|
| Complexity | 177 |
| 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 | 7 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number