草居蕈酸
TL;DR: 草居蕈酸 (CAS 539-98-0) is a chemical compound with molecular formula C11H10O3 and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
草居蕈酸
4-hydroxyundeca-5,6-dien-8,10-diynoic acid
Also Known As: Nemotinic acid, 4-hydroxyundeca-5,6-diene-8,10-diynoic acid, 4-hydroxyundeca-5,6-dien-8,10-diynoic acid, 5,6-Undecadiene-8,10-diynoic acid, 4-hydroxy-, 4-03-00-01048 (Beilstein Handbook Reference)
| Molecular Formula | C11H10O3 |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 0.56 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 190.06299 |
| Heavy Atoms | 14 |
| Complexity | 342.9545 |
Chemical Identifiers
| CAS Number | 539-98-0 |
|---|---|
| SMILES | C#CC#CC=C=CC(CCC(=O)O)O |
Product Overview
草居蕈酸 (CAS 539-98-0), with molecular formula C11H10O3 and molecular weight 190.06 g/mol. IUPAC: 4-hydroxyundeca-5,6-dien-8,10-diynoic acid.
Chemical Property Profile of 草居蕈酸
Property Insights of 草居蕈酸
The XLogP value of 0.56 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 草居蕈酸. With a topological polar surface area (TPSA) of 57.53 Ų, 草居蕈酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 草居蕈酸 has 2 hydrogen bond donor(s) and 2 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 草居蕈酸?
The CAS number of 草居蕈酸 is 539-98-0.
What is the molecular formula of 草居蕈酸?
The molecular formula of 草居蕈酸 is C11H10O3.
What is the molecular weight of 草居蕈酸?
The molecular weight of 草居蕈酸 is 190.06 g/mol.
Where can I buy 草居蕈酸?
You can request a quote for 草居蕈酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 草居蕈酸?
Yes, KEHONG BIO provides custom synthesis services for 草居蕈酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.