| CAS Number | 165279-79-8 |
| Catalog Number | AG00ADKY(AGN-PC-0WBMX4) |
| Chemical Name | Depropylamino chloro propafenone |
| IUPAC Name | 1-[2-(3-chloro-2-hydroxypropoxy)phenyl]-3-phenylpropan-1-one |
| InChI | InChI=1S/C18H19ClO3/c19-12-15(20)13-22-18-9-5-4-8-16(18)17(21)11-10-14-6-2-1-3-7-14/h1-9,15,20H,10-13H2 |
| InChI Key | MSNQYFAIUPNYQK-UHFFFAOYSA-N |
| MDL Number | MFCD21363754 |
| Molecular Formula | C18H19ClO3 |
| Molecular Weight | 318.7947 |
| SMILES | OC(CCl)COc1ccccc1C(=O)CCc2ccccc2 |
| Synonyms | Depropylamino Chloro Propafenone,
165279-79-8,
1-(2-((2RS)-3-Chloro-2-hydroxypropoxy)phenyl)-3-phenylpropan-1-one,
1-[2-[(2RS)-3-Chloro-2-hydroxypropoxy]phenyl]-3-phenylpropan-1-one,
Propafenone Impurity E,
Propafenone hydrochloride impurity E [EP],
1-Propanone, 1-(2-(3-chloro-2-hydroxypropoxy)phenyl)-3-phenyl-,
ACM165279798,
FT-0665907,
1-[2-(3-Chloro-2-hydroxypropoxy)phenyl]-3-phenyl-1-propanone,
1-[2-(3-chloro-2-hydroxypropoxy)phenyl]-3-phenylpropan-1-one,
Propafenone EP Impurity E,
UNII-P98EG35Z18,
P98EG35Z18,
CS-T-15674,
|
| Complexity | 328 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 318.102g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 318.797g/mol |
| Monoisotopic Mass | 318.102g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number