AC1LLNEX
2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]terephthalic acid
Also Known As: starbld0044086|Oprea1_507068|Oprea1_765008|BV02|BAS 00130674|J3.322.128B|SR-01000370542-1|2-((1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl)terephthalic acid|2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamoyl]benzene-1,4-dicarboxylic acid|2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]terephthalic acid|2-[(2,3-Dimethyl-1-phenyl-5-oxo-3-pyrazoline-4-yl)carbamoyl]-1,4-benzenedicarboxylic acid
CAS: 302602-92-2
| Molecular Formula | C20H17N3O6 |
|---|---|
| Molecular Weight | 395.11172 g/mol |
| LogP | 2.13312 |
| Topological Polar Surface Area | 130.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.11172 |
| Monoisotopic Mass | 395.11172 |
| Heavy Atoms | 29 |
| Complexity | 1190.9159 |
Chemical Identifiers
| CAS Number | 302602-92-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O |
Product Overview
AC1LLNEX (CAS 302602-92-2), with molecular formula C20H17N3O6 and molecular weight 395.11172 g/mol. IUPAC: 2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]terephthalic 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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