| CAS Number | 1135104-24-3 |
| Catalog Number | AG019XVJ |
| Chemical Name | Ethyl 2-([(4-methylphenyl)methyl]amino)acetate hydrochloride |
| IUPAC Name | ethyl 2-[(4-methylphenyl)methylamino]acetate;hydrochloride |
| InChI | InChI=1S/C12H17NO2.ClH/c1-3-15-12(14)9-13-8-11-6-4-10(2)5-7-11;/h4-7,13H,3,8-9H2,1-2H3;1H |
| InChI Key | BDYLXFUWTZERAV-UHFFFAOYSA-N |
| MDL Number | MFCD13368220 |
| Molecular Formula | C12H18ClNO2 |
| Molecular Weight | 243.7298 |
| NSC Number | 181503 |
| SMILES | Cl.CCOC(CNCC1=CC=C(C)C=C1)=O |
| Synonyms | ethyl 2-{[(4-methylphenyl)methyl]amino}acetate hydrochloride,
1135104-24-3,
AC1Q39XW,
CTK6F9001,
NSC181503,
AKOS008065396,
MCULE-1618331243,
NE60459,
NSC-181503,
EN300-56149,
ethyl 2-([(4-methylphenyl)methyl]amino)acetate hydrochloride,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.731g/mol |
| Monoisotopic Mass | 243.103g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 38.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number