| CAS Number | 1251924-33-0 |
| Catalog Number | AG01A9WW |
| Chemical Name | benzyl 3-(aminomethyl)benzoate hydrochloride |
| IUPAC Name | benzyl 3-(aminomethyl)benzoate;hydrochloride |
| InChI | InChI=1S/C15H15NO2.ClH/c16-10-13-7-4-8-14(9-13)15(17)18-11-12-5-2-1-3-6-12;/h1-9H,10-11,16H2;1H |
| InChI Key | PRZLLLIQMALKGO-UHFFFAOYSA-N |
| MDL Number | MFCD16817479 |
| Molecular Formula | C15H16ClNO2 |
| Molecular Weight | 277.7460 |
| SMILES | Cl.NCC1=CC(C(OCC2=CC=CC=C2)=O)=CC=C1 |
| Synonyms | benzyl 3-(aminomethyl)benzoate hydrochloride,
1251924-33-0,
AC1Q3D6E,
MCULE-3566114469,
NE22116,
EN300-66402,
Z1263529577,
|
| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.087g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.748g/mol |
| Monoisotopic Mass | 277.087g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number