CHOCOLATE Powder
TL;DR: CHOCOLATE Powder (CAS 90532-97-1) is a chemical compound with molecular formula C47H36N6Na2O12S4 and molecular weight 1050.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;6-amino-5-[[2-[4-[2-[4-[2-[(2-amino-5-sulfonatonaphthalen-1-yl)diazenyl]phenyl]sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonylphenyl]diazenyl]naphthalene-1-sulfonate
Also Known As: CHOCOLATE Powder, 1-Naphthalenesulfonic acid, 5,5'-((1-methylethylidene)bis(4,1-phenyleneoxysulfonyl-2,1-phenylene-2,1-diazenediyl))bis(6-amino-, sodium salt (1:2), 1-Naphthalenesulfonic acid, 5,5'-((1-methylethylidene)bis(4,1-phenyleneoxysulfonyl-2,1-phenyleneazo))bis(6-amino-, disodium salt, disodium 5,5'-{propane-2,2-diylbis[benzene-4,1-diyloxysulfonylbenzene-2,1-diyl(e)diazene-2,1-diyl]}bis(6-aminonaphthalene-1-sulfonate), 1-Naphthalenesulfonic acid, 5,5'-[(1-methylethylidene)bis(4,1-phenyleneoxysulfonyl-2,1-phenylene-2,1-diazenediyl)]bis[6-amino-, sodium salt (1:2)
| Molecular Formula | C47H36N6Na2O12S4 |
|---|---|
| Molecular Weight | 1050.11 g/mol |
| LogP | 3.6657 |
| Topological Polar Surface Area | 336.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 12 |
| Exact Mass | 1050.1069 |
| Heavy Atoms | 71 |
| Complexity | 2070.0 |
Chemical Identifiers
| CAS Number | 90532-97-1 |
|---|---|
| SMILES | CC(C)(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2N=NC3=C(C=CC4=C3C=CC=C4S(=O)(=O)[O-])N)C5=CC=C(C=C5)OS(=O)(=O)C6=CC=CC=C6N=NC7=C(C=CC8=C7C=CC=C8S(=O)(=O)[O-])N.[Na+].[Na+] |
| InChIKey | YSXLJTGZMRNQSG-UHFFFAOYSA-L |
Product Overview
CHOCOLATE Powder (CAS 90532-97-1), with molecular formula C47H36N6Na2O12S4 and molecular weight 1050.11 g/mol. IUPAC: disodium;6-amino-5-[[2-[4-[2-[4-[2-[(2-amino-5-sulfonatonaphthalen-1-yl)diazenyl]phenyl]sulfonyloxyphenyl]propan-2-yl]phenoxy]sulfonylphenyl]diazenyl]naphthalene-1-sulfonate.
Chemical Property Profile of CHOCOLATE Powder
Property Insights of CHOCOLATE Powder
The XLogP value of 3.6657 indicates that CHOCOLATE Powder is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 336.0 Ų indicates high polarity, suggesting CHOCOLATE Powder may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CHOCOLATE Powder has 2 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CHOCOLATE Powder?
The CAS number of CHOCOLATE Powder is 90532-97-1.
What is the molecular formula of CHOCOLATE Powder?
The molecular formula of CHOCOLATE Powder is C47H36N6Na2O12S4.
What is the molecular weight of CHOCOLATE Powder?
The molecular weight of CHOCOLATE Powder is 1050.11 g/mol.
Where can I buy CHOCOLATE Powder?
You can request a quote for CHOCOLATE Powder directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CHOCOLATE Powder?
Yes, KEHONG BIO provides custom synthesis services for CHOCOLATE Powder and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.