| CAS Number | 926221-50-3 |
| Catalog Number | AG019MBK |
| Chemical Name | 2-(4-Aminophenyl)-N-(tert-butyl)acetamide |
| IUPAC Name | 2-(4-aminophenyl)-N-tert-butylacetamide |
| InChI | InChI=1S/C12H18N2O/c1-12(2,3)14-11(15)8-9-4-6-10(13)7-5-9/h4-7H,8,13H2,1-3H3,(H,14,15) |
| InChI Key | SXIHUFHYSBSZDS-UHFFFAOYSA-N |
| MDL Number | MFCD09044738 |
| Molecular Formula | C12H18N2O |
| Molecular Weight | 206.2841 |
| SMILES | CC(NC(CC1=CC=C(N)C=C1)=O)(C)C |
| Synonyms | 2-(4-aminophenyl)-N-tert-butylacetamide,
2-(4-aminophenyl)-N-(tert-butyl)acetamide,
926221-50-3,
AC1Q1MM7,
CTK7G1033,
ZINC12481040,
AKOS000128466,
MCULE-1903683664,
NE61179,
EN300-35683,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.289g/mol |
| Monoisotopic Mass | 206.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number