![三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 structure](/static/products/3619/36195-09-2.webp)
三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸
TL;DR: 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 (CAS 36195-09-2) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸
tricyclo[5.1.0.02,4]octane-3,8-dicarboxylic acid
Also Known As: Tricyclooctan-dicarbonsaeure-(3,8), Tricyclo[5.1.0.02,4]octane-3,8-dicarboxylic acid, Tricyclo[5.1.0.0~2,4~]octane-3,8-dicarboxylic acid
| Molecular Formula | C10H12O4 |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.07356 |
| Heavy Atoms | 14 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 36195-09-2 |
|---|---|
| SMILES | C1CC2C(C2C(=O)O)C3C1C3C(=O)O |
| InChIKey | JVSSILFTPGXXLY-UHFFFAOYSA-N |
Product Overview
三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 (CAS 36195-09-2), with molecular formula C10H12O4 and molecular weight 196.07 g/mol. IUPAC: tricyclo[5.1.0.02,4]octane-3,8-dicarboxylic acid.
Chemical Property Profile of 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸
Property Insights of 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸. Following Lipinski's Rule of Five, 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 has 2 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 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸?
The CAS number of 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 is 36195-09-2.
What is the molecular formula of 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸?
The molecular formula of 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 is C10H12O4.
What is the molecular weight of 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸?
The molecular weight of 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 is 196.07 g/mol.
Where can I buy 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸?
You can request a quote for 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸?
Yes, KEHONG BIO provides custom synthesis services for 三环[5.1.0.0²,⁴]辛烷-3,8-二甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.