吡哆醇3-硫酸酯
TL;DR: 吡哆醇3-硫酸酯 (CAS 107467-06-1) is a chemical compound with molecular formula C8H11NO6S and molecular weight 249.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡哆醇3-硫酸酯
[4,5-bis(hydroxymethyl)-2-methyl-3-pyridinyl] hydrogen sulfate
Also Known As: Pyridoxine 3-sulfate, 6-Methyl-5-(sulfooxy)-3,4-pyridinedimethanol, [4,5-bis(hydroxymethyl)-2-methylpyridin-3-yl] hydrogen sulfate, 3,4-Pyridinedimethanol,6-methyl-5-(sulfooxy), 3,4-Pyridinedimethanol, 6-methyl-5-(sulfooxy)-
| Molecular Formula | C8H11NO6S |
|---|---|
| Molecular Weight | 249.03 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.0307 |
| Heavy Atoms | 16 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 107467-06-1 |
|---|---|
| SMILES | CC1=NC=C(C(=C1OS(=O)(=O)O)CO)CO |
| InChIKey | KEXPIEQVJDWERO-UHFFFAOYSA-N |
Product Overview
吡哆醇3-硫酸酯 (CAS 107467-06-1), with molecular formula C8H11NO6S and molecular weight 249.03 g/mol. IUPAC: [4,5-bis(hydroxymethyl)-2-methyl-3-pyridinyl] hydrogen sulfate.
Chemical Property Profile of 吡哆醇3-硫酸酯
Property Insights of 吡哆醇3-硫酸酯
The XLogP value of -1.0 indicates that 吡哆醇3-硫酸酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 吡哆醇3-硫酸酯. Following Lipinski's Rule of Five, 吡哆醇3-硫酸酯 has 3 hydrogen bond donor(s) and 7 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 吡哆醇3-硫酸酯?
The CAS number of 吡哆醇3-硫酸酯 is 107467-06-1.
What is the molecular formula of 吡哆醇3-硫酸酯?
The molecular formula of 吡哆醇3-硫酸酯 is C8H11NO6S.
What is the molecular weight of 吡哆醇3-硫酸酯?
The molecular weight of 吡哆醇3-硫酸酯 is 249.03 g/mol.
Where can I buy 吡哆醇3-硫酸酯?
You can request a quote for 吡哆醇3-硫酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡哆醇3-硫酸酯?
Yes, KEHONG BIO provides custom synthesis services for 吡哆醇3-硫酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.