| CAS Number | 3575-60-8 |
| Catalog Number | AG00J3TY |
| Chemical Name | 1-(2-bromophenoxy)-3-(diisopropylamino)-2-propanol hydrochloride |
| IUPAC Name | 1-(2-bromophenoxy)-3-[di(propan-2-yl)amino]propan-2-ol;hydrochloride |
| InChI | InChI=1S/C15H24BrNO2.ClH/c1-11(2)17(12(3)4)9-13(18)10-19-15-8-6-5-7-14(15)16;/h5-8,11-13,18H,9-10H2,1-4H3;1H |
| InChI Key | PWPRNDKZDLKVPI-UHFFFAOYSA-N |
| MDL Number | MFCD05983763 |
| Molecular Formula | C15H25BrClNO2 |
| Molecular Weight | 366.7215 |
| SMILES | N(C(C)C)(C(C)C)CC(O)COC1C=CC=CC=1Br.Cl |
| Synonyms | 1-(2-Bromophenoxy)-3-(diisopropylamino)-2-propanol hydrochloride,
3575-60-8,
AC1MF95I,
ZX-CM017036,
MFCD05983763,
MCULE-9701611898,
SR-01000244429,
SR-01000244429-1,
1-(2-bromophenoxy)-3-[di(propan-2-yl)amino]propan-2-ol hydrochloride,
|
| Complexity | 240 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 365.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 366.724g/mol |
| Monoisotopic Mass | 365.076g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 32.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number