AC1MMR0I
3,5-dibromo-2-[(4-propan-2-yloxybenzoyl)carbamothioylamino]benzoic acid
Also Known As: 3,5-dibromo-2-[(4-propan-2-yloxybenzoyl)carbamothioylamino]benzoic acid|3,5-dibromo-2-[(4-propan-2-yloxybenzoyl)thiocarbamoylamino]benzoic Acid|3,5-DIBROMO-2-[[[[4- BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOICACID|3,5-Dibromo-2-[[[[4-(1-methylethoxy)benzoyl ]amino]thioxomethyl ]amino]-benzoic acid
CAS: 530153-91-4
| Molecular Formula | C18H16Br2N2O4S |
|---|---|
| Molecular Weight | 513.91974 g/mol |
| LogP | 4.8238 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 513.91974 |
| Monoisotopic Mass | 515.9177 |
| Heavy Atoms | 27 |
| Complexity | 885.67554 |
Chemical Identifiers
| CAS Number | 530153-91-4 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=C(C=C(C=C2Br)Br)C(=O)O |
Product Overview
AC1MMR0I (CAS 530153-91-4), with molecular formula C18H16Br2N2O4S and molecular weight 513.91974 g/mol. IUPAC: 3,5-dibromo-2-[(4-propan-2-yloxybenzoyl)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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