Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)
TL;DR: Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) (CAS 94825-60-2) is a chemical compound with molecular formula C42H40N4O20S5 and molecular weight 1080.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid;4-amino-5-hydroxynaphthalene-2,7-disulfonic acid;6-amino-4-hydroxynaphthalene-2-sulfonic acid;2-hydroxy-3-methylbenzoic acid
Also Known As: Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid), Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis[5-aminobenzenesulfonic acid], 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid; 4-amino-5-hydroxynaphthalene-2,7-disulfonic acid; 6-amino-4-hydroxynaphthalene-2-sulfonic acid; 2-hydroxy-3-methylbenzoic acid, Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis[5-aminobenzene sulfonic acid]
| Molecular Formula | C42H40N4O20S5 |
|---|---|
| Molecular Weight | 1080.08 g/mol |
| LogP | 4.90892 |
| Topological Polar Surface Area | 473.92 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 8 |
| Exact Mass | 1080.084 |
| Heavy Atoms | 71 |
| Complexity | 3711.8872 |
Chemical Identifiers
| CAS Number | 94825-60-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)O)O.C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)O)N.C1=CC(=C(C=C1N)S(=O)(=O)O)/C=C/C2=C(C=C(C=C2)N)S(=O)(=O)O.C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O |
Product Overview
Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) (CAS 94825-60-2), with molecular formula C42H40N4O20S5 and molecular weight 1080.08 g/mol. IUPAC: 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid;4-amino-5-hydroxynaphthalene-2,7-disulfonic acid;6-amino-4-hydroxynaphthalene-2-sulfonic acid;2-hydroxy-3-methylbenzoic acid.
Chemical Property Profile of Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)
Property Insights of Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)
The XLogP value of 4.90892 indicates that Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 473.92 Ų indicates high polarity, suggesting Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) has 13 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 Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)?
The CAS number of Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) is 94825-60-2.
What is the molecular formula of Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)?
The molecular formula of Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) is C42H40N4O20S5.
What is the molecular weight of Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)?
The molecular weight of Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) is 1080.08 g/mol.
Where can I buy Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)?
You can request a quote for Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid)?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-hydroxy-3-methyl-, reaction products with 4-amino-5-hydroxy-2,7-naphthalenedisulfonic acid, 6-amino-4-hydroxy-2-naphthalenesulfonic acid and 2,2'-(1,2-ethenediyl)bis(5-aminobenzenesulfonic acid) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.