cis-1,2-Cyclohexanedicarboxylic acid
TL;DR: cis-1,2-Cyclohexanedicarboxylic acid (CAS 619-81-8) is a chemical compound with molecular formula C8H12O4 and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-(1R,2S)-cyclohexane-1,2-dicarboxylic acid
Also Known As: cis-1,2-Cyclohexanedicarboxylic acid, cis-Cyclohexane-1,2-dicarboxylic acid, cis-Hexahydrophthalic acid, (1R,2S)-cyclohexane-1,2-dicarboxylic acid, Mitiglinide Impurity 15
| Molecular Formula | C8H12O4 |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.07356 |
| Heavy Atoms | 12 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 619-81-8 |
|---|---|
| SMILES | C1CC[C@@H]([C@@H](C1)C(=O)O)C(=O)O |
| InChIKey | QSAWQNUELGIYBC-OLQVQODUSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
cis-1,2-Cyclohexanedicarboxylic acid (CAS 619-81-8), with molecular formula C8H12O4 and molecular weight 172.07 g/mol. IUPAC: cis-(1R,2S)-cyclohexane-1,2-dicarboxylic acid.
Chemical Property Profile of cis-1,2-Cyclohexanedicarboxylic acid
Property Insights of cis-1,2-Cyclohexanedicarboxylic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-1,2-Cyclohexanedicarboxylic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-1,2-Cyclohexanedicarboxylic acid. Following Lipinski's Rule of Five, cis-1,2-Cyclohexanedicarboxylic acid 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 cis-1,2-Cyclohexanedicarboxylic acid?
The CAS number of cis-1,2-Cyclohexanedicarboxylic acid is 619-81-8.
What is the molecular formula of cis-1,2-Cyclohexanedicarboxylic acid?
The molecular formula of cis-1,2-Cyclohexanedicarboxylic acid is C8H12O4.
What is the molecular weight of cis-1,2-Cyclohexanedicarboxylic acid?
The molecular weight of cis-1,2-Cyclohexanedicarboxylic acid is 172.07 g/mol.
Where can I buy cis-1,2-Cyclohexanedicarboxylic acid?
You can request a quote for cis-1,2-Cyclohexanedicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-1,2-Cyclohexanedicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for cis-1,2-Cyclohexanedicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.