2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one
TL;DR: 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one (CAS 6627-26-5) is a chemical compound with molecular formula C12H14O2 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,6,7,8,9-hexahydro-1H-dibenzofuran-4-one
Also Known As: 2,3,6,7,8,9-hexahydrodibenzo[b,d]furan-4(1h)-one, 2,3,6,7,8,9-hexahydro-1H-dibenzofuran-4-one
| Molecular Formula | C12H14O2 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.09938 |
| Heavy Atoms | 14 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 6627-26-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(O2)C(=O)CCC3 |
| InChIKey | MIRMQDLZCUVIQF-UHFFFAOYSA-N |
Product Overview
2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one (CAS 6627-26-5), with molecular formula C12H14O2 and molecular weight 190.10 g/mol. IUPAC: 2,3,6,7,8,9-hexahydro-1H-dibenzofuran-4-one.
Chemical Property Profile of 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one
Property Insights of 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one. With a topological polar surface area (TPSA) of 30.2 Ų, 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-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 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one?
The CAS number of 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one is 6627-26-5.
What is the molecular formula of 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one?
The molecular formula of 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one is C12H14O2.
What is the molecular weight of 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one?
The molecular weight of 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one is 190.10 g/mol.
Where can I buy 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one?
You can request a quote for 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3,6,7,8,9-Hexahydrodibenzo[b,d]furan-4(1h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.