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5-[(3-Acetyloxyphenyl)carbonylamino]benzene-1,3-dicarboxylic acid
5-[(3-acetyloxybenzoyl)amino]benzene-1,3-dicarboxylic acid
Also Known As: Oprea1_738733|5-(3-acetoxybenzamido)isophthalic acid|5-(3-acetoxybenzoylamino)isophthalic acid|SR-01000218811-1|5-[(3-acetyloxybenzoyl)amino]benzene-1,3-dicarboxylic Acid|5-[(3-acetyloxyphenyl)carbonylamino]benzene-1,3-dicarboxylic acid|5-({[3-(acetyloxy)phenyl]carbonyl}amino)benzene-1,3-dicarboxylic acid
CAS: 420102-23-4
| Molecular Formula | C17H13NO7 |
|---|---|
| Molecular Weight | 343.0692 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 343.0692 |
| Monoisotopic Mass | 343.0692 |
| Heavy Atoms | 25 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 420102-23-4 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC(=C1)C(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O |
| InChIKey | QHDYURDPTRZPQX-UHFFFAOYSA-N |
Product Overview
5-[(3-Acetyloxyphenyl)carbonylamino]benzene-1,3-dicarboxylic acid (CAS 420102-23-4), with molecular formula C17H13NO7 and molecular weight 343.0692 g/mol. IUPAC: 5-[(3-acetyloxybenzoyl)amino]benzene-1,3-dicarboxylic 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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