AC1NC8IX
2-methyl-3-[[2-(4-propan-2-ylphenoxy)acetyl]carbamothioylamino]benzoic acid
Also Known As: 2-Methyl-3-[[[[[4-(1-methylethyl)phenoxy]acetyl ]amino]thioxomethyl ]amino]-benzoic acid|2-methyl-3-[[2-(4-propan-2-ylphenoxy)acetyl]carbamothioylamino]benzoic acid|2-methyl-3-[[2-(4-propan-2-ylphenoxy)acetyl]thiocarbamoylamino]benzoic Acid
CAS: 532409-36-2
| Molecular Formula | C20H22N2O4S |
|---|---|
| Molecular Weight | 386.13004 g/mol |
| LogP | 3.70862 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.13004 |
| Monoisotopic Mass | 386.13004 |
| Heavy Atoms | 27 |
| Complexity | 847.56024 |
Chemical Identifiers
| CAS Number | 532409-36-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1NC(=S)NC(=O)COC2=CC=C(C=C2)C(C)C)C(=O)O |
Product Overview
AC1NC8IX (CAS 532409-36-2), with molecular formula C20H22N2O4S and molecular weight 386.13004 g/mol. IUPAC: 2-methyl-3-[[2-(4-propan-2-ylphenoxy)acetyl]carbamothioylamino]benzoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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