| CAS Number | 1048948-05-5 |
| Catalog Number | AG00J3ZP |
| Chemical Name | N-(3-ethoxybenzyl)ethanamine hydrochloride |
| IUPAC Name | N-[(3-ethoxyphenyl)methyl]ethanamine;hydrochloride |
| InChI | InChI=1S/C11H17NO.ClH/c1-3-12-9-10-6-5-7-11(8-10)13-4-2;/h5-8,12H,3-4,9H2,1-2H3;1H |
| InChI Key | UTBQXLWYQDTCKW-UHFFFAOYSA-N |
| MDL Number | MFCD07108409 |
| Molecular Formula | C11H18ClNO |
| Molecular Weight | 215.7197 |
| SMILES | C1=C(C=CC=C1OCC)CNCC.Cl |
| Synonyms | N-(3-Ethoxybenzyl)ethanamine hydrochloride,
1048948-05-5,
ZX-CM018001,
MFCD07108409,
MCULE-3301884693,
|
| Complexity | 127 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.721g/mol |
| Monoisotopic Mass | 215.108g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number