| CAS Number | 76765-62-3 |
| Catalog Number | AG005UQB(AGN-PC-0WB40O) |
| Chemical Name | 3-Amino-N-isopropyl-4-methylbenzamide |
| IUPAC Name | 3-amino-4-methyl-N-propan-2-ylbenzamide |
| InChI | InChI=1S/C11H16N2O/c1-7(2)13-11(14)9-5-4-8(3)10(12)6-9/h4-7H,12H2,1-3H3,(H,13,14) |
| InChI Key | BOJJGTFACPPFRY-UHFFFAOYSA-N |
| MDL Number | MFCD09049376 |
| Molecular Formula | C11H16N2O |
| Molecular Weight | 192.2575 |
| SMILES | C(=O)(NC(C)C)C1C=CC(=C(N)C=1)C |
| Synonyms | 3-AMINO-N-ISOPROPYL-4-METHYLBENZAMIDE,
76765-62-3,
SCHEMBL13576993,
CTK5E3405,
DTXSID00504230,
MFCD09049376,
ZINC19092699,
AKOS000113285,
MCULE-9185267092,
AJ-71886,
3-Amino-4-methyl-N-(propan-2-yl)benzamide,
Y-4952,
Benzamide, 3-amino-4-methyl-N-(1-methylethyl)-,
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| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 192.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 192.262g/mol |
| Monoisotopic Mass | 192.126g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number