![Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate structure](/static/products/7017/70172-42-8.webp)
Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate
TL;DR: Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate (CAS 70172-42-8) is a chemical compound with molecular formula C11H14Br2O4 and molecular weight 367.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate
Also Known As: dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate, dimethyl 2,3-dibromobicyclo[2.2.1]heptane-5,6-dicarboxylate
| Molecular Formula | C11H14Br2O4 |
|---|---|
| Molecular Weight | 367.93 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.92587 |
| Heavy Atoms | 17 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 70172-42-8 |
|---|---|
| SMILES | COC(=O)C1C2CC(C1C(=O)OC)C(C2Br)Br |
| InChIKey | KBRJVBWTARLNHP-UHFFFAOYSA-N |
Product Overview
Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate (CAS 70172-42-8), with molecular formula C11H14Br2O4 and molecular weight 367.93 g/mol. IUPAC: dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate.
Chemical Property Profile of Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate
Property Insights of Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate has 0 hydrogen bond donor(s) and 4 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 Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate?
The CAS number of Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate is 70172-42-8.
What is the molecular formula of Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate?
The molecular formula of Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate is C11H14Br2O4.
What is the molecular weight of Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate?
The molecular weight of Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate is 367.93 g/mol.
Where can I buy Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate?
You can request a quote for Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 5,6-dibromobicyclo[2.2.1]heptane-2,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.