![Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate structure](/static/products/849/849060-95-3.png)
Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate
TL;DR: Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate (CAS 849060-95-3) is a chemical compound with molecular formula C12H12F2O2 and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 10,10-difluoropentacyclo[5.3.0.02,5.03,9.04,8]decane-2-carboxylate
Also Known As: methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate, methyl 10,10-difluoropentacyclo[5.3.0.02,5.03,9.04,8]decane-2-carboxylate, methyl 10,10-difluoropentacyclo[5.3.0.0?,?.0?,?.0?,?]decane-2-carboxylate, methyl 10,10-difluoropentacyclo[5.3.0.0^{2,5}.0^{3,9}.0^{4,8}]decane-2-carboxylate, methyl 6,6-difluoropentacyclo[5.3.0.0<2,5>.0<3,10>.0<4,8>]decanecarboxylate
| Molecular Formula | C12H12F2O2 |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 1.5526 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.08054 |
| Heavy Atoms | 16 |
| Complexity | 448.2997 |
Chemical Identifiers
| CAS Number | 849060-95-3 |
|---|---|
| SMILES | COC(=O)C12C3CC4C1C(C5C4C3C25)(F)F |
Product Overview
Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate (CAS 849060-95-3), with molecular formula C12H12F2O2 and molecular weight 226.08 g/mol. IUPAC: methyl 10,10-difluoropentacyclo[5.3.0.02,5.03,9.04,8]decane-2-carboxylate.
Chemical Property Profile of Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate
Property Insights of Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate
The XLogP value of 1.5526 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate 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 Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate?
The CAS number of Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate is 849060-95-3.
What is the molecular formula of Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate?
The molecular formula of Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate is C12H12F2O2.
What is the molecular weight of Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate?
The molecular weight of Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate is 226.08 g/mol.
Where can I buy Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate?
You can request a quote for Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 10,10-difluoropentacyclo[5.3.0.0~2,5~.0~3,9~.0~4,8~]decane-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.