| CAS Number | 731821-83-3 |
| Catalog Number | AG00FC53(AGN-PC-0WR4GP) |
| Chemical Name | 2-(4-acetylphenoxy)-N,N-dimethylacetamide |
| IUPAC Name | 2-(4-acetylphenoxy)-N,N-dimethylacetamide |
| InChI | InChI=1S/C12H15NO3/c1-9(14)10-4-6-11(7-5-10)16-8-12(15)13(2)3/h4-7H,8H2,1-3H3 |
| InChI Key | KOQVBLNNUYSLCR-UHFFFAOYSA-N |
| MDL Number | MFCD04628567 |
| Molecular Formula | C12H15NO3 |
| Molecular Weight | 221.2524 |
| SMILES | O=C(N(C)C)COC1=CC=C(C(C)=O)C=C1 |
| Synonyms | 2-(4-acetylphenoxy)-N,N-dimethylacetamide,
731821-83-3,
AC1M73CR,
AC1Q3W0D,
SCHEMBL334299,
CTK7G2101,
ZINC3294785,
MFCD04628567,
AKOS000203238,
MCULE-5313077529,
NE12967,
2-(4-Acetylphenoxy)-n,n-dimethyl-acetamide,
EN300-07329,
SR-01000048182,
J-505886,
SR-01000048182-1,
Z19661152,
ZINC03294785,
CID2410365,
|
| Complexity | 255 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.256g/mol |
| Monoisotopic Mass | 221.105g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number