Xylenol blue sodium salt indicator
TL;DR: Xylenol blue sodium salt indicator (CAS 303136-70-1) is a chemical compound with molecular formula C23H21NaO5S and molecular weight 432.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 2-[(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(4-hydroxy-2,5-dimethylphenyl)methyl]benzenesulfonate
Also Known As: XYLENOL BLUE SODIUM SALT INDICATOR, sodium 2-[(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(4-hydroxy-2,5-dimethylphenyl)methyl]benzenesulfonate, Sodium;2-[(E)-(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(4-hydroxy-2,5-dimethylphenyl)methyl]benzenesulfonate
| Molecular Formula | C23H21NaO5S |
|---|---|
| Molecular Weight | 432.10 g/mol |
| LogP | 1.19434 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 432.10074 |
| Heavy Atoms | 30 |
| Complexity | 1234.235 |
Chemical Identifiers
| CAS Number | 303136-70-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1O)C)C(=C2C=C(C(=O)C=C2C)C)C3=CC=CC=C3S(=O)(=O)[O-].[Na+] |
Product Overview
Xylenol blue sodium salt indicator (CAS 303136-70-1), with molecular formula C23H21NaO5S and molecular weight 432.10 g/mol. IUPAC: sodium 2-[(2,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(4-hydroxy-2,5-dimethylphenyl)methyl]benzenesulfonate.
Chemical Property Profile of Xylenol blue sodium salt indicator
Property Insights of Xylenol blue sodium salt indicator
The XLogP value of 1.19434 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Xylenol blue sodium salt indicator. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Xylenol blue sodium salt indicator. Following Lipinski's Rule of Five, Xylenol blue sodium salt indicator has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Xylenol blue sodium salt indicator?
The CAS number of Xylenol blue sodium salt indicator is 303136-70-1.
What is the molecular formula of Xylenol blue sodium salt indicator?
The molecular formula of Xylenol blue sodium salt indicator is C23H21NaO5S.
What is the molecular weight of Xylenol blue sodium salt indicator?
The molecular weight of Xylenol blue sodium salt indicator is 432.10 g/mol.
Where can I buy Xylenol blue sodium salt indicator?
You can request a quote for Xylenol blue sodium salt indicator directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xylenol blue sodium salt indicator?
Yes, KEHONG BIO provides custom synthesis services for Xylenol blue sodium salt indicator and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.