| CAS Number | 1311316-44-5 |
| Catalog Number | AG01AIYI |
| Chemical Name | methyl 2-[(methylamino)methyl]benzoate hydrochloride |
| IUPAC Name | methyl 2-(methylaminomethyl)benzoate;hydrochloride |
| InChI | InChI=1S/C10H13NO2.ClH/c1-11-7-8-5-3-4-6-9(8)10(12)13-2;/h3-6,11H,7H2,1-2H3;1H |
| InChI Key | UFTVPJZVXWMXGT-UHFFFAOYSA-N |
| MDL Number | MFCD18917417 |
| Molecular Formula | C10H14ClNO2 |
| Molecular Weight | 215.6767 |
| SMILES | Cl.CNCC1=C(C(OC)=O)C=CC=C1 |
| Synonyms | methyl 2-[(methylamino)methyl]benzoate hydrochloride,
1311316-44-5,
AKOS008139557,
MCULE-5895939490,
NE19793,
EN300-79356,
Z1268152318,
|
| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.071306g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.67g/mol |
| Monoisotopic Mass | 215.071306g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.3Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number