| CAS Number | 1051368-43-4 |
| Catalog Number | AG00J422 |
| Chemical Name | 3-[(4-bromobenzyl)amino]-1-propanol hydrochloride |
| IUPAC Name | 3-[(4-bromophenyl)methylamino]propan-1-ol;hydrochloride |
| InChI | InChI=1S/C10H14BrNO.ClH/c11-10-4-2-9(3-5-10)8-12-6-1-7-13;/h2-5,12-13H,1,6-8H2;1H |
| InChI Key | LPFHMIGVWSFQQG-UHFFFAOYSA-N |
| MDL Number | MFCD08134533 |
| Molecular Formula | C10H15BrClNO |
| Molecular Weight | 280.5892 |
| SMILES | C1(C=CC(CNCCCO)=CC=1)Br.Cl |
| Synonyms | 3-[(4-Bromobenzyl)amino]-1-propanol hydrochloride,
1051368-43-4,
ZX-CM018237,
MFCD08134533,
721453-52-7,
|
| Complexity | 124 |
| 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 | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.59g/mol |
| Monoisotopic Mass | 279.003g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number