Account Calcium 4-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)-6-hydroxybenzene-1,3-disulfonate
- Catalog No. :
- ACPTLW483
- CAS No. :
- 3536-49-0
- Molecular Formula :
- C54H62CaN4O14S4
- Molecular Weight :
- 1159.45
IUPAC Name:calcium 4-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)-6-hydroxybenzene-1,3-disulfonate
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Product Information
| Product Name | Calcium 4-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)-6-hydroxybenzene-1,3-disulfonate |
|---|---|
| IUPAC Name | calcium 4-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)-6-hydroxybenzene-1,3-disulfonate |
| MDL No. | MFCD00038746 |
| Molecular Formula | C54H62CaN4O14S4 |
| Molecular Weight | 1159.45 |
| SMILES | O=S(C1=C(O)C=C(/C(C2=CC=C(N(CC)CC)C=C2)=C3C=C/C(C=C/3)=[N+](CC)\CC)C(S(=O)([O-])=O)=C1)([O-])=O.O=S(C4=C(O)C=C(/C(C5=CC=C(N(CC)CC)C=C5)=C6C=C/C(C=C/6)=[N+](CC)\CC)C(S(=O)([O-])=O)=C4)([O-])=O.[Ca+2] |
| InChI Key | RTMBGDBBDQKNNZ-UHFFFAOYSA-L |
| Synonym | 4,4',4''-methanetriyltris(N,N-dimethylaniline) | ACID BLUE 3 [INCI] | C.I. Acid Blue 3 | CI FOOD BLUE 5 | PATENT BLUE V (E 131) | Patent Blue V and L | EINECS 222-573-8 | Ethanaminium, N-[4-[[4-(diethylamino)phenyl](5-hydroxy-2,4-disulfophenyl)methylene]- |
| CAS No. | 3536-49-0 |
| PubChem CID | 77073 |
Synthetic Route by SureRoute
2. ACPTLW483 Molecular Building Block Synthetic Route
2-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)-4-hydroxy-5-sulfobenzenesulfonate
sodium 4-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)-6-hydroxybenzene-1,3-disulfonate
Sodium 4-((4-(diethylamino)phenyl)(4-(diethyliminio)cyclohexa-2,5-dien-1-ylidene)methyl)benzene-1,3-disulfonate