自體誘導物2
TL;DR: 自體誘導物2 (CAS 406683-36-1) is a chemical compound with molecular formula C5H10BO7- and molecular weight 193.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
自體誘導物2
(1R,5S,8S)-3,3-dihydroxy-5-methyl-2,4,6-trioxa-3-boranuidabicyclo[3.3.0]octane-1,8-diol
Also Known As: Autoinducer 2, Autoinducer II, AI-2 autoinducer, (S)-THMF-borate, AI-2 (vibrio)
| Molecular Formula | C5H10BO7- |
|---|---|
| Molecular Weight | 193.05 g/mol |
| LogP | -2.7507 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 193.05196 |
| Heavy Atoms | 13 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 406683-36-1 |
|---|---|
| SMILES | [B-]1(O[C@@]2([C@](O1)([C@H](CO2)O)O)C)(O)O |
| InChIKey | ACKRRKSNOOISSG-VPENINKCSA-N |
Product Overview
自體誘導物2 (CAS 406683-36-1), with molecular formula C5H10BO7- and molecular weight 193.05 g/mol. IUPAC: (1R,5S,8S)-3,3-dihydroxy-5-methyl-2,4,6-trioxa-3-boranuidabicyclo[3.3.0]octane-1,8-diol.
Chemical Property Profile of 自體誘導物2
Property Insights of 自體誘導物2
The XLogP value of -2.7507 indicates that 自體誘導物2 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 自體誘導物2. Following Lipinski's Rule of Five, 自體誘導物2 has 4 hydrogen bond donor(s) and 8 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 自體誘導物2?
The CAS number of 自體誘導物2 is 406683-36-1.
What is the molecular formula of 自體誘導物2?
The molecular formula of 自體誘導物2 is C5H10BO7-.
What is the molecular weight of 自體誘導物2?
The molecular weight of 自體誘導物2 is 193.05 g/mol.
Where can I buy 自體誘導物2?
You can request a quote for 自體誘導物2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 自體誘導物2?
Yes, KEHONG BIO provides custom synthesis services for 自體誘導物2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.