1,3,6-Naphthalenetrisulfonate
TL;DR: 1,3,6-Naphthalenetrisulfonate (CAS 19437-42-4) is a chemical compound with molecular formula C10H5O9S3-3 and molecular weight 364.90958 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
naphthalene-1,3,6-trisulfonate
Also Known As: naphthalene trisulfonate, naphthalene-1,3,6-trisulfonate, 1,3,6-naphthalenetrisulfonate, naphthalene-1,3,6-trisulfonate(3-), 1,3,6-Naphthalene trisulfonic acid
Technical Specifications
| Molecular Formula | C10H5O9S3-3 |
| Molecular Weight | 364.90958 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 197.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 364.90958 Da |
| Heavy Atoms | 22 |
| Complexity | 680.0 |
| SMILES | C1=CC2=C(C=C(C=C2C=C1S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-] |
| InChIKey | ZPBSAMLXSQCSOX-UHFFFAOYSA-K |
Chemical Property Profile of 1,3,6-Naphthalenetrisulfonate
Property Insights of 1,3,6-Naphthalenetrisulfonate
The XLogP value of -0.8 indicates that 1,3,6-Naphthalenetrisulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 197.0 Ų indicates high polarity, suggesting 1,3,6-Naphthalenetrisulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3,6-Naphthalenetrisulfonate has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3,6-Naphthalenetrisulfonate?
The CAS number of 1,3,6-Naphthalenetrisulfonate is 19437-42-4.
What is the molecular formula of 1,3,6-Naphthalenetrisulfonate?
The molecular formula of 1,3,6-Naphthalenetrisulfonate is C10H5O9S3-3.
What is the molecular weight of 1,3,6-Naphthalenetrisulfonate?
The molecular weight of 1,3,6-Naphthalenetrisulfonate is 364.90958 g/mol.
Where can I buy 1,3,6-Naphthalenetrisulfonate?
You can request a quote for 1,3,6-Naphthalenetrisulfonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3,6-Naphthalenetrisulfonate?
Yes, CoreyChem provides custom synthesis services for 1,3,6-Naphthalenetrisulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.