Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate
TL;DR: Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate (CAS 29800-57-5) is a chemical compound with molecular formula C10H10O2 and molecular weight 162.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl tetracyclo[3.3.0.02,4.03,6]oct-7-ene-4-carboxylate
Also Known As: 4-Carbomethoxytetracyclo[3.3.0.0(2,4).0(3,6)]oct-7-ene, Methyl tetracyclo[3.3.0.02,4.03,8]oct-6-ene-2-carboxylate, Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate, methyl tetracyclo[3.3.0.02,4.03,6]oct-7-ene-4-carboxylate, Methyl tetracyclo[3.3.0.0~2,4~.0~3,6~]oct-7-ene-4-carboxylate
| Molecular Formula | C10H10O2 |
|---|---|
| Molecular Weight | 162.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 162.06808 |
| Heavy Atoms | 12 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 29800-57-5 |
|---|---|
| SMILES | COC(=O)C12C3C4C1C2C3C=C4 |
| InChIKey | ZYUUTDYDFBJIDO-UHFFFAOYSA-N |
Product Overview
Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate (CAS 29800-57-5), with molecular formula C10H10O2 and molecular weight 162.07 g/mol. IUPAC: methyl tetracyclo[3.3.0.02,4.03,6]oct-7-ene-4-carboxylate.
Chemical Property Profile of Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate
Property Insights of Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-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 tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate?
The CAS number of Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate is 29800-57-5.
What is the molecular formula of Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate?
The molecular formula of Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate is C10H10O2.
What is the molecular weight of Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate?
The molecular weight of Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate is 162.07 g/mol.
Where can I buy Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate?
You can request a quote for Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-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 tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl tetracyclo(3.3.0.02,4.03,8)oct-6-ene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.