| CAS Number | 1609400-43-2 |
| Catalog Number | AG00J3UG |
| Chemical Name | N-(2-[(1-Bromo-2-naphthyl)oxy]ethyl)-3-methoxy-1-propanamine hydrochloride |
| IUPAC Name | N-[2-(1-bromonaphthalen-2-yl)oxyethyl]-3-methoxypropan-1-amine;hydrochloride |
| InChI | InChI=1S/C16H20BrNO2.ClH/c1-19-11-4-9-18-10-12-20-15-8-7-13-5-2-3-6-14(13)16(15)17;/h2-3,5-8,18H,4,9-12H2,1H3;1H |
| InChI Key | HXSKXEDSCYTUKO-UHFFFAOYSA-N |
| MDL Number | MFCD13186580 |
| Molecular Formula | C16H21BrClNO2 |
| Molecular Weight | 374.7004 |
| SMILES | C1(Br)=C(OCCNCCCOC)C=CC2C=CC=CC1=2.Cl |
| Synonyms | N-{2-[(1-Bromo-2-naphthyl)oxy]ethyl}-3-methoxy-1-propanamine hydrochloride,
1609400-43-2,
ZX-CM017162,
MFCD13186580,
435284-61-0,
|
| Complexity | 265 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 373.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 374.703g/mol |
| Monoisotopic Mass | 373.044g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 30.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number