土曲霉酮
TL;DR: 土曲霉酮 (CAS 582-46-7) is a chemical compound with molecular formula C8H10O3 and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
土曲霉酮
4,5-dihydroxy-3-prop-1-enylcyclopent-2-en-1-one
Also Known As: Terrein, 4,5-dihydroxy-3-propenyl-cyclopent-2-enone, NCI60_002395, 4,5-dihydroxy-3-prop-1-enylcyclopent-2-en-1-one, 4,5-dihydroxy-3-(1-propenyl)-2-cyclopenten-1-one
| Molecular Formula | C8H10O3 |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.06299 |
| Heavy Atoms | 11 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 582-46-7 |
|---|---|
| SMILES | CC=CC1=CC(=O)C(C1O)O |
| InChIKey | MHOOPNKRBMHHEC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
土曲霉酮 (CAS 582-46-7), with molecular formula C8H10O3 and molecular weight 154.06 g/mol. IUPAC: 4,5-dihydroxy-3-prop-1-enylcyclopent-2-en-1-one.
Chemical Property Profile of 土曲霉酮
Property Insights of 土曲霉酮
The XLogP value of -0.6 indicates that 土曲霉酮 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.5 Ų, 土曲霉酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 土曲霉酮 has 2 hydrogen bond donor(s) and 3 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 土曲霉酮?
The CAS number of 土曲霉酮 is 582-46-7.
What is the molecular formula of 土曲霉酮?
The molecular formula of 土曲霉酮 is C8H10O3.
What is the molecular weight of 土曲霉酮?
The molecular weight of 土曲霉酮 is 154.06 g/mol.
Where can I buy 土曲霉酮?
You can request a quote for 土曲霉酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 土曲霉酮?
Yes, KEHONG BIO provides custom synthesis services for 土曲霉酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.