| CAS Number | 1609399-86-1 |
| Catalog Number | AG00J3MD(AGN-PC-0WRAXB) |
| Chemical Name | N-(3-Methoxybenzyl)-1,2,3,4-tetrahydronaphthalen-1-amine hydrobromide |
| IUPAC Name | N-[(3-methoxyphenyl)methyl]-1,2,3,4-tetrahydronaphthalen-1-amine;hydrobromide |
| InChI | InChI=1S/C18H21NO.BrH/c1-20-16-9-4-6-14(12-16)13-19-18-11-5-8-15-7-2-3-10-17(15)18;/h2-4,6-7,9-10,12,18-19H,5,8,11,13H2,1H3;1H |
| InChI Key | NDTBDLHQCOTCIB-UHFFFAOYSA-N |
| MDL Number | MFCD13186429 |
| Molecular Formula | C18H22BrNO |
| Molecular Weight | 348.2774 |
| SMILES | C12C=CC=CC=1CCCC2NCC1=CC=CC(OC)=C1.Br |
| Synonyms | 1609399-86-1,
N-(3-methoxybenzyl)-1,2,3,4-tetrahydro-1-naphthalenamine hydrobromide,
N-(3-Methoxybenzyl)-1,2,3,4-tetrahydronaphthalen-1-amine hydrobromide,
ZX-CM015784,
MFCD13186429,
AKOS027426857,
356092-08-5,
|
| Complexity | 293 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 347.088g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 348.284g/mol |
| Monoisotopic Mass | 347.088g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number