(4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one
TL;DR: (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one (CAS 15413-34-0) 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.
(4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one
Also Known As: (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one, 3(4H)-Dibenzofuranone, 4a,9b-dihydro-8,9b-dimethyl-, cis-, (4aR,9bR)-8,9b-Dimethyl-4a,9b-dihydrodibenzo[b,d]furan-3(4H)-one, 4a,9b-dihydro-8,9b-dimethyl-3-(4H)-dibenzofuranone (Pummerer's ketone), RefChem:313939
| Molecular Formula | C14H14O2 |
|---|---|
| Molecular Weight | 214.10 g/mol |
| LogP | 2.54272 |
| 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 | 501.45685 |
Chemical Identifiers
| CAS Number | 15413-34-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)O[C@H]3[C@@]2(C=CC(=O)C3)C |
Product Overview
(4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one (CAS 15413-34-0), with molecular formula C14H14O2 and molecular weight 214.10 g/mol. IUPAC: (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one.
Chemical Property Profile of (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one
Property Insights of (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one
The XLogP value of 2.54272 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one. With a topological polar surface area (TPSA) of 26.3 Ų, (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one 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 (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one?
The CAS number of (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one is 15413-34-0.
What is the molecular formula of (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one?
The molecular formula of (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one is C14H14O2.
What is the molecular weight of (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one?
The molecular weight of (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one is 214.10 g/mol.
Where can I buy (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one?
You can request a quote for (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4aR,9bR)-8,9b-dimethyl-4,4a-dihydrodibenzofuran-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.