| CAS Number | 112077-95-9 |
| Catalog Number | AG009U67(AGN-PC-00OEAD) |
| Chemical Name | N-(4-aminophenyl)-N-methylpropanamide |
| IUPAC Name | N-(4-aminophenyl)-N-methylpropanamide |
| InChI | InChI=1S/C10H14N2O/c1-3-10(13)12(2)9-6-4-8(11)5-7-9/h4-7H,3,11H2,1-2H3 |
| InChI Key | GNQLYIOPOBUPER-UHFFFAOYSA-N |
| MDL Number | MFCD11184901 |
| Molecular Formula | C10H14N2O |
| Molecular Weight | 178.231 |
| SMILES | CCC(N(C1=CC=C(N)C=C1)C)=O |
| Synonyms | N-(4-aminophenyl)-N-methylpropionamide,
112077-95-9,
SCHEMBL737988,
CTK8G5818,
GNQLYIOPOBUPER-UHFFFAOYSA-N,
N-propionyl-N-methyl-4-aminoaniline,
ZINC20374173,
Propanamide, N-(4-aminophenyl)-N-methyl-,
|
| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.235g/mol |
| Monoisotopic Mass | 178.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
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Certificate of Analysis
Lot Number