SOLVENT ORANGE 56
TL;DR: SOLVENT ORANGE 56 (CAS 12227-68-8) is a chemical compound with molecular formula C32H23CrN10O14S2 and molecular weight 887.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
chromium(3+);3-(dioxidoamino)-5-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinylidene]-6-oxocyclohexa-1,3-diene-1-sulfonate;hydron;3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate
Also Known As: SOLVENT ORANGE 56, C.I. Solvent Orange 5, C.I.Solvent Orange 56, C.I. SOLVENT ORANGE 56, Chromium(3+);3-(dioxidoamino)-5-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinylidene]-6-oxocyclohexa-1,3-diene-1-sulfonate;hydron;3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate
| Molecular Formula | C32H23CrN10O14S2 |
|---|---|
| Molecular Weight | 887.02 g/mol |
| LogP | 2.29 |
| Topological Polar Surface Area | 389.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 5 |
| Exact Mass | 887.0242 |
| Heavy Atoms | 59 |
| Complexity | 705.0 |
Chemical Identifiers
| CAS Number | 12227-68-8 |
|---|---|
| SMILES | [H+].[H+].[H+].CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)[N+](=O)[O-])S(=O)(=O)[O-])[O-])[O-])C3=CC=CC=C3.CC1=NN(C(=O)C1=NN=C2C=C(C=C(C2=O)S(=O)(=O)[O-])N([O-])[O-])C3=CC=CC=C3.[Cr+3] |
| InChIKey | UWONCBFTAQWRFD-UHFFFAOYSA-M |
Product Overview
SOLVENT ORANGE 56 (CAS 12227-68-8), with molecular formula C32H23CrN10O14S2 and molecular weight 887.02 g/mol. IUPAC: chromium(3+);3-(dioxidoamino)-5-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinylidene]-6-oxocyclohexa-1,3-diene-1-sulfonate;hydron;3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate.
Chemical Property Profile of SOLVENT ORANGE 56
Property Insights of SOLVENT ORANGE 56
The XLogP value of 2.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SOLVENT ORANGE 56. The TPSA of 389.0 Ų indicates high polarity, suggesting SOLVENT ORANGE 56 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, SOLVENT ORANGE 56 has 3 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SOLVENT ORANGE 56?
The CAS number of SOLVENT ORANGE 56 is 12227-68-8.
What is the molecular formula of SOLVENT ORANGE 56?
The molecular formula of SOLVENT ORANGE 56 is C32H23CrN10O14S2.
What is the molecular weight of SOLVENT ORANGE 56?
The molecular weight of SOLVENT ORANGE 56 is 887.02 g/mol.
Where can I buy SOLVENT ORANGE 56?
You can request a quote for SOLVENT ORANGE 56 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SOLVENT ORANGE 56?
Yes, KEHONG BIO provides custom synthesis services for SOLVENT ORANGE 56 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.