普梅尔酮
TL;DR: 普梅尔酮 (CAS 546-24-7) is a chemical compound with molecular formula C14H14O2 and molecular weight 214.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
普梅尔酮
8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one
Also Known As: Pummerer's ketone, Pumerrer's ketone, Pummerer//'s ketone, Pummerer/'s ketone, 8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one
| Molecular Formula | C14H14O2 |
|---|---|
| Molecular Weight | 214.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 214.09938 |
| Heavy Atoms | 16 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 546-24-7 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)OC3C2(C=CC(=O)C3)C |
| InChIKey | RGTPQXAKJODXMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
普梅尔酮 (CAS 546-24-7), with molecular formula C14H14O2 and molecular weight 214.10 g/mol. IUPAC: 8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one.
Chemical Property Profile of 普梅尔酮
Property Insights of 普梅尔酮
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 普梅尔酮. With a topological polar surface area (TPSA) of 26.3 Ų, 普梅尔酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 普梅尔酮 has 0 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 普梅尔酮?
The CAS number of 普梅尔酮 is 546-24-7.
What is the molecular formula of 普梅尔酮?
The molecular formula of 普梅尔酮 is C14H14O2.
What is the molecular weight of 普梅尔酮?
The molecular weight of 普梅尔酮 is 214.10 g/mol.
Where can I buy 普梅尔酮?
You can request a quote for 普梅尔酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 普梅尔酮?
Yes, KEHONG BIO provides custom synthesis services for 普梅尔酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.