![2-[[4-(2-Carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid structure](/static/products/4046/4046-39-3.webp)
2-[[4-(2-Carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid
2-[[4-(2-carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid
Also Known As: 2-[[4-(2-carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid|SR-01000203515-1|2-[[4-(2-carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]am|2,2'-[(3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)diimino]dibenzoic acid|2,6-DIOXO-1,4-CYCLOHEXADIENE-1,4-DIYL)DIIMINO]BIS(BENZOIC ACID)|2,2''-(3,6-dioxocyclohexa-1,4-diene-1,4-diyl)bis(azanediyl)dibenzoic acid|2,2'-[(3,6-Dioxocyclohexa-1,4-diene-1,4-diyl)bis(azanediyl)]dibenzoic acid|2-[[4-[(2-Carboxyphenyl)amino]-3,6-dioxo-1-cyclohexa-1,4-dienyl]amino]benzoic acid
| Molecular Formula | C20H14N2O6 |
|---|---|
| Molecular Weight | 378.08517 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.08517 |
| Monoisotopic Mass | 378.08517 |
| Heavy Atoms | 28 |
| Complexity | 679.0 |
Chemical Identifiers
| CAS Number | 4046-39-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=CC(=O)C(=CC2=O)NC3=CC=CC=C3C(=O)O |
| InChIKey | ZICRATSMKAPMHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[[4-(2-Carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid (CAS 4046-39-3), with molecular formula C20H14N2O6 and molecular weight 378.08517 g/mol. IUPAC: 2-[[4-(2-carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid.
2-[[4-(2-Carboxyanilino)-3,6-dioxocyclohexa-1,4-dien-1-yl]amino]benzoic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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