| CAS Number | 1049784-01-1 |
| Catalog Number | AG00J3MJ |
| Chemical Name | N-(5-Bromo-2-methoxybenzyl)ethanamine hydrochloride |
| IUPAC Name | N-[(5-bromo-2-methoxyphenyl)methyl]ethanamine;hydrochloride |
| InChI | InChI=1S/C10H14BrNO.ClH/c1-3-12-7-8-6-9(11)4-5-10(8)13-2;/h4-6,12H,3,7H2,1-2H3;1H |
| InChI Key | NPAAWUSEDXSKSU-UHFFFAOYSA-N |
| MDL Number | MFCD06620095 |
| Molecular Formula | C10H15BrClNO |
| Molecular Weight | 280.5892 |
| SMILES | CCNCC1=C(C=CC(=C1)Br)OC.Cl |
| Synonyms | N-(5-BROMO-2-METHOXYBENZYL)ETHANAMINE HYDROCHLORIDE,
869949-75-7,
AC1MEB4V,
CTK5F7554,
DTXSID80386076,
MFCD06620095,
AKOS022184472,
MCULE-2621183935,
SR-01000213030,
SR-01000213030-1,
N-(5-Bromo-2-methoxybenzyl)ethanamine hydrochloride x1hcl,
N-[(5-bromo-2-methoxyphenyl)methyl]ethanamine hydrochloride,
N-[(5-Bromo-2-methoxyphenyl)methyl]ethanamine--hydrogen chloride (1/1),
1049784-01-1,
N- ETHANAMINEHYDROCHLORIDE,
CID2852366,
N-[(5-bromo-2-methoxy-phenyl)methyl]ethanamine Hydrochloride,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.003g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.59g/mol |
| Monoisotopic Mass | 279.003g/mol |
| Rotatable Bond Count | 4 |
| 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