| CAS Number | 1609402-79-0 |
| Catalog Number | AG00J40O(AGN-PC-0WB7FT) |
| Chemical Name | 3-(3-Ethylphenoxy)-N-methylpropan-1-amine hydrochloride |
| IUPAC Name | 3-(3-ethylphenoxy)-N-methylpropan-1-amine;hydrochloride |
| InChI | InChI=1S/C12H19NO.ClH/c1-3-11-6-4-7-12(10-11)14-9-5-8-13-2;/h4,6-7,10,13H,3,5,8-9H2,1-2H3;1H |
| InChI Key | PESXZOKETVYNNG-UHFFFAOYSA-N |
| MDL Number | MFCD26959494 |
| Molecular Formula | C12H20ClNO |
| Molecular Weight | 229.7463 |
| SMILES | C1=C(CC)C=CC=C1OCCCNC.Cl |
| Synonyms | 1609402-79-0,
[3-(3-Ethylphenoxy)propyl]methylamine hydrochloride,
ZX-CM018109,
MFCD26959494,
AKOS027426652,
3-(3-Ethylphenoxy)-N-methylpropan-1-amine hydrochloride,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.123g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.748g/mol |
| Monoisotopic Mass | 229.123g/mol |
| Rotatable Bond Count | 6 |
| 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