3,4-Dihydroxycyclohexanecarboxylic acid
TL;DR: 3,4-Dihydroxycyclohexanecarboxylic acid (CAS 32746-99-9) is a chemical compound with molecular formula C7H12O4 and molecular weight 160.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydroxycyclohexane-1-carboxylic acid
Also Known As: 3,4-Dihydroxycyclohexanecarboxylic acid, 4-Amidinobenzenesulfonylfluoride, Cyclohexanecarboxylic acid, 3,4-dihydroxy-, 3,4-Dihydroxycyclohexanecarboxylicacid, 3,4-dihydroxycyclohexane-1-carboxylic acid
| Molecular Formula | C7H12O4 |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.07356 |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 32746-99-9 |
|---|---|
| SMILES | C1CC(C(CC1C(=O)O)O)O |
| InChIKey | PTPROPUVXIZJPL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dihydroxycyclohexanecarboxylic acid (CAS 32746-99-9), with molecular formula C7H12O4 and molecular weight 160.07 g/mol. IUPAC: 3,4-dihydroxycyclohexane-1-carboxylic acid.
Chemical Property Profile of 3,4-Dihydroxycyclohexanecarboxylic acid
Property Insights of 3,4-Dihydroxycyclohexanecarboxylic acid
The XLogP value of -0.6 indicates that 3,4-Dihydroxycyclohexanecarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydroxycyclohexanecarboxylic acid. Following Lipinski's Rule of Five, 3,4-Dihydroxycyclohexanecarboxylic acid has 3 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 3,4-Dihydroxycyclohexanecarboxylic acid?
The CAS number of 3,4-Dihydroxycyclohexanecarboxylic acid is 32746-99-9.
What is the molecular formula of 3,4-Dihydroxycyclohexanecarboxylic acid?
The molecular formula of 3,4-Dihydroxycyclohexanecarboxylic acid is C7H12O4.
What is the molecular weight of 3,4-Dihydroxycyclohexanecarboxylic acid?
The molecular weight of 3,4-Dihydroxycyclohexanecarboxylic acid is 160.07 g/mol.
Where can I buy 3,4-Dihydroxycyclohexanecarboxylic acid?
You can request a quote for 3,4-Dihydroxycyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydroxycyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydroxycyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.