Account Benzoic acid, 3,3'-[(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methylene]bis[6-hydroxy-, calcium salt (2:3)
- Catalog No. :
- ACGDLC044
- CAS No. :
- 63451-31-0
- Molecular Formula :
- C44H22Ca3O18
- Molecular Weight :
- 958.88
IUPAC Name:calcium 3-(bis(3-carboxy-4-oxidophenyl)methylene)-6-oxocyclohexa-1,4-diene-1-carboxylate
![Benzoic acid, 3,3'-[(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methylene]bis[6-hydroxy-, calcium salt (2:3) structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Benzoic acid, 3,3'-[(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methylene]bis[6-hydroxy-, calcium salt (2:3) |
|---|---|
| IUPAC Name | calcium 3-(bis(3-carboxy-4-oxidophenyl)methylene)-6-oxocyclohexa-1,4-diene-1-carboxylate |
| Molecular Formula | C44H22Ca3O18 |
| Molecular Weight | 958.88 |
| SMILES | O=C(C=C1)C(C([O-])=O)=CC1=C(C2=CC(C([O-])=O)=C(O)C=C2)C3=CC(C([O-])=O)=C(O)C=C3.O=C(C=C4)C(C([O-])=O)=CC4=C(C5=CC(C([O-])=O)=C(O)C=C5)C6=CC(C([O-])=O)=C(O)C=C6.[Ca+2].[Ca+2].[Ca+2] |
| InChI Key | FCCFCJZQKSDVNM-UHFFFAOYSA-H |
| Synonym | calcium 5,5'-[(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methylene]bissalicylate (2:3);Benzoic acid, 3,3-(3-carboxy-4-oxo-2,5-cyclohexadien-1-ylidene)methylenebis6-hydroxy-, calcium salt (2:3);aurintricarboxylic acid, calcium salt |
| CAS No. | 63451-31-0 |
Synthetic Route by SureRoute
2. ACGDLC044 Molecular Building Block Synthetic Route
Ammonium 5,5'-((3-carboxylato-4-oxocyclohexa-2,5-dien-1-ylidene)methylene)bis(2-hydroxybenzoate)
Sodium 5,5'-((3-carboxylato-4-oxocyclohexa-2,5-dien-1-ylidene)methylene)bis(2-hydroxybenzoate)
5,5'-((3-Carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylene)bis(2-hydroxybenzoic acid)