| CAS Number | 727983-43-9 |
| Catalog Number | AG00ICBM(AGN-PC-0WR4HQ) |
| Chemical Name | 2-(4-acetylphenoxy)-N,N-diethylacetamide |
| IUPAC Name | 2-(4-acetylphenoxy)-N,N-diethylacetamide |
| InChI | InChI=1S/C14H19NO3/c1-4-15(5-2)14(17)10-18-13-8-6-12(7-9-13)11(3)16/h6-9H,4-5,10H2,1-3H3 |
| InChI Key | HVIBYRYGXOHRIT-UHFFFAOYSA-N |
| MDL Number | MFCD04620408 |
| Molecular Formula | C14H19NO3 |
| Molecular Weight | 249.3056 |
| SMILES | CCN(C(COC1=CC=C(C(C)=O)C=C1)=O)CC |
| Synonyms | 2-(4-acetylphenoxy)-N,N-diethylacetamide,
727983-43-9,
AC1M8RM0,
AC1Q2YU5,
SCHEMBL334579,
CTK6E6939,
HVIBYRYGXOHRIT-UHFFFAOYSA-N,
ZINC3374746,
MFCD04620408,
AKOS000203235,
MCULE-3530644175,
NE12922,
EN300-08551,
SR-01000046747,
SR-01000046747-1,
Z19661262,
ZINC03374746,
CID2492457,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 249.31g/mol |
| Monoisotopic Mass | 249.136g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number