| CAS Number | 1462-98-2 |
| Catalog Number | AG00AMRG(AGN-PC-0PYHVV) |
| Chemical Name | Ethyl 3-(tert-butylamino)propanoate |
| IUPAC Name | ethyl 3-(tert-butylamino)propanoate |
| InChI | InChI=1S/C9H19NO2/c1-5-12-8(11)6-7-10-9(2,3)4/h10H,5-7H2,1-4H3 |
| InChI Key | MRBYLBKVCAGYBL-UHFFFAOYSA-N |
| MDL Number | MFCD01475854 |
| Molecular Formula | C9H19NO2 |
| Molecular Weight | 173.2527 |
| SMILES | CCOC(CCNC(C)(C)C)=O |
| Synonyms | Ethyl 3-(tert-butylamino)propanoate,
1462-98-2,
AC1MWRSX,
SCHEMBL11186122,
CTK6F8787,
KS-00001L0N,
ZINC5325499,
4449AD,
MFCD01475854,
AKOS005289668,
MCULE-3589466050,
NE23275,
TR-050122,
3-(tert-Butylamino)propionic acid ethyl ester,
C9H19NO2,
CID3804063,
.beta.-Alanine, N-(1,1-dimethylethyl)-, ethyl ester,
N/A,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.256g/mol |
| Monoisotopic Mass | 173.142g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number