Pyrenocine C
TL;DR: Pyrenocine C (CAS 94474-69-8) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-1-hydroxybut-2-enyl]-4-methoxy-6-methylpyran-2-one
Also Known As: Pyrenocin C, Pyrenocine C, Pyrenocin C putative, 5-[(E)-1-hydroxybut-2-enyl]-4-methoxy-6-methylpyran-2-one, 5-((E)-1-hydroxybut-2-enyl)-4-methoxy-6-methylpyran-2-one
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.56632 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 417.08636 |
Chemical Identifiers
| CAS Number | 94474-69-8 |
|---|---|
| SMILES | C/C=C/C(C1=C(OC(=O)C=C1OC)C)O |
Product Overview
Pyrenocine C (CAS 94474-69-8), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: 5-[(E)-1-hydroxybut-2-enyl]-4-methoxy-6-methylpyran-2-one.
Chemical Property Profile of Pyrenocine C
Property Insights of Pyrenocine C
The XLogP value of 1.56632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrenocine C. With a topological polar surface area (TPSA) of 59.67 Ų, Pyrenocine C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrenocine C has 1 hydrogen bond donor(s) and 4 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 Pyrenocine C?
The CAS number of Pyrenocine C is 94474-69-8.
What is the molecular formula of Pyrenocine C?
The molecular formula of Pyrenocine C is C11H14O4.
What is the molecular weight of Pyrenocine C?
The molecular weight of Pyrenocine C is 210.09 g/mol.
Where can I buy Pyrenocine C?
You can request a quote for Pyrenocine C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrenocine C?
Yes, KEHONG BIO provides custom synthesis services for Pyrenocine C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.