黄柄曲菌素
TL;DR: 黄柄曲菌素 (CAS 483-53-4) is a chemical compound with molecular formula C9H8O5 and molecular weight 196.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
黄柄曲菌素
3,4,5-trihydroxy-6-methylphthalaldehyde
Also Known As: Flavipin, 3,4,5-trihydroxy-6-methylphthalaldehyde, Phthalaldehyde, 3,4,5-trihydroxy-6-methyl-, 3,4,5-Trihydroxy-6-methyl-1,2-benzenedicarboxaldehyde, 1,2-Benzenedicarboxaldehyde, 3,4,5-trihydroxy-6-methyl-
| Molecular Formula | C9H8O5 |
|---|---|
| Molecular Weight | 196.04 g/mol |
| LogP | 0.73682 |
| Topological Polar Surface Area | 94.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.03717 |
| Heavy Atoms | 14 |
| Complexity | 369.3987 |
Chemical Identifiers
| CAS Number | 483-53-4 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1O)O)O)C=O)C=O |
Product Overview
黄柄曲菌素 (CAS 483-53-4), with molecular formula C9H8O5 and molecular weight 196.04 g/mol. IUPAC: 3,4,5-trihydroxy-6-methylphthalaldehyde.
Chemical Property Profile of 黄柄曲菌素
Property Insights of 黄柄曲菌素
The XLogP value of 0.73682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 黄柄曲菌素. The TPSA of 94.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 黄柄曲菌素. Following Lipinski's Rule of Five, 黄柄曲菌素 has 3 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 黄柄曲菌素?
The CAS number of 黄柄曲菌素 is 483-53-4.
What is the molecular formula of 黄柄曲菌素?
The molecular formula of 黄柄曲菌素 is C9H8O5.
What is the molecular weight of 黄柄曲菌素?
The molecular weight of 黄柄曲菌素 is 196.04 g/mol.
Where can I buy 黄柄曲菌素?
You can request a quote for 黄柄曲菌素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 黄柄曲菌素?
Yes, KEHONG BIO provides custom synthesis services for 黄柄曲菌素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.