| CAS Number | 1050419-22-1 |
| Catalog Number | AG00J3YY |
| Chemical Name | N-(3-ethoxybenzyl)cyclopropanamine hydrochloride |
| IUPAC Name | N-[(3-ethoxyphenyl)methyl]cyclopropanamine;hydrochloride |
| InChI | InChI=1S/C12H17NO.ClH/c1-2-14-12-5-3-4-10(8-12)9-13-11-6-7-11;/h3-5,8,11,13H,2,6-7,9H2,1H3;1H |
| InChI Key | QCANWDYNGFZNSF-UHFFFAOYSA-N |
| MDL Number | MFCD07112123 |
| Molecular Formula | C12H18ClNO |
| Molecular Weight | 227.7304 |
| SMILES | C1(NCC2C=CC=C(OCC)C=2)CC1.Cl |
| Synonyms | N-(3-Ethoxybenzyl)cyclopropanamine hydrochloride,
1050419-22-1,
ZX-CM017933,
MFCD07112123,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.732g/mol |
| Monoisotopic Mass | 227.108g/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