C.I. Acid Brown 105
TL;DR: C.I. Acid Brown 105 (CAS 8003-78-9) is a chemical compound with molecular formula C30H21ClN6Na2O8S2 and molecular weight 738.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;5-[2-[5-[[4-[(3-chloro-2-methyl-5-sulfonatophenyl)diazenyl]-3-methylphenyl]hydrazinylidene]-2,6-dioxocyclohex-3-en-1-ylidene]hydrazinyl]naphthalene-2-sulfonate
Also Known As: C.I. Acid Brown 105, 2-Naphthalenesulfonic acid, 5(or 8)-[[3-[[4-[(3-chloro-2-methyl-5-sulfophenyl)azo]-3-methylphenyl]azo]-2,6-dihydroxyphenyl]azo]-, disodium salt, 2-Naphthalenesulfonic acid, 5(or 8)-((3-((4-((3-chloro-2-methyl-5-sulfophenyl)azo)-3-methylphenyl)azo)-2,6-dihydroxyphenyl)azo)-, disodium salt, 2-Naphthalenesulfonic acid, 5(or 8)-(2-(3-(2-(4-(2-(3-chloro-2-methyl-5-sulfophenyl)diazenyl)-3-methylphenyl)diazenyl)-2,6-dihydroxyphenyl)diazenyl)-, sodium salt (1:2), Disodium (5or8)-[[3-[[4-[(3-chloro-2-methyl-5-sulphonatophenyl)azo]-3-methylphenyl]azo]-2,6-dihydroxyphenyl]azo]naphthalene-2-sulphonate
| Molecular Formula | C30H21ClN6Na2O8S2 |
|---|---|
| Molecular Weight | 738.03 g/mol |
| LogP | -2.20676 |
| Topological Polar Surface Area | 239.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 6 |
| Exact Mass | 738.0346 |
| Heavy Atoms | 49 |
| Complexity | 1510.0 |
Chemical Identifiers
| CAS Number | 8003-78-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)NN=C2C=CC(=O)C(=NNC3=CC=CC4=C3C=CC(=C4)S(=O)(=O)[O-])C2=O)N=NC5=C(C(=CC(=C5)S(=O)(=O)[O-])Cl)C.[Na+].[Na+] |
| InChIKey | YMZWPAZGIDBOQB-UHFFFAOYSA-L |
Product Overview
C.I. Acid Brown 105 (CAS 8003-78-9), with molecular formula C30H21ClN6Na2O8S2 and molecular weight 738.03 g/mol. IUPAC: disodium;5-[2-[5-[[4-[(3-chloro-2-methyl-5-sulfonatophenyl)diazenyl]-3-methylphenyl]hydrazinylidene]-2,6-dioxocyclohex-3-en-1-ylidene]hydrazinyl]naphthalene-2-sulfonate.
Chemical Property Profile of C.I. Acid Brown 105
Property Insights of C.I. Acid Brown 105
The XLogP value of -2.20676 indicates that C.I. Acid Brown 105 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 239.0 Ų indicates high polarity, suggesting C.I. Acid Brown 105 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C.I. Acid Brown 105 has 2 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C.I. Acid Brown 105?
The CAS number of C.I. Acid Brown 105 is 8003-78-9.
What is the molecular formula of C.I. Acid Brown 105?
The molecular formula of C.I. Acid Brown 105 is C30H21ClN6Na2O8S2.
What is the molecular weight of C.I. Acid Brown 105?
The molecular weight of C.I. Acid Brown 105 is 738.03 g/mol.
Where can I buy C.I. Acid Brown 105?
You can request a quote for C.I. Acid Brown 105 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C.I. Acid Brown 105?
Yes, KEHONG BIO provides custom synthesis services for C.I. Acid Brown 105 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.