3,4,5,6-Tetrahydrophthalic acid
TL;DR: 3,4,5,6-Tetrahydrophthalic acid (CAS 635-08-5) is a chemical compound with molecular formula C8H10O4 and molecular weight 170.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexene-1,2-dicarboxylic acid
Also Known As: phthalic acid, Cyclohexene-1,2-dicarboxylic acid, 3,4,5,6-Tetrahydrophthalic acid, CYCLOHEX-1-ENE-1,2-DICARBOXYLIC ACID, 1-Cyclohexene-1,2-dicarboxylic acid
| Molecular Formula | C8H10O4 |
|---|---|
| Molecular Weight | 170.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.0579 |
| Heavy Atoms | 12 |
| Complexity | 226.0 |
Chemical Identifiers
| CAS Number | 635-08-5 |
|---|---|
| SMILES | C1CCC(=C(C1)C(=O)O)C(=O)O |
| InChIKey | UFDHBDMSHIXOKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5,6-Tetrahydrophthalic acid (CAS 635-08-5), with molecular formula C8H10O4 and molecular weight 170.06 g/mol. IUPAC: cyclohexene-1,2-dicarboxylic acid.
Chemical Property Profile of 3,4,5,6-Tetrahydrophthalic acid
Property Insights of 3,4,5,6-Tetrahydrophthalic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5,6-Tetrahydrophthalic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,5,6-Tetrahydrophthalic acid. Following Lipinski's Rule of Five, 3,4,5,6-Tetrahydrophthalic 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 3,4,5,6-Tetrahydrophthalic acid?
The CAS number of 3,4,5,6-Tetrahydrophthalic acid is 635-08-5.
What is the molecular formula of 3,4,5,6-Tetrahydrophthalic acid?
The molecular formula of 3,4,5,6-Tetrahydrophthalic acid is C8H10O4.
What is the molecular weight of 3,4,5,6-Tetrahydrophthalic acid?
The molecular weight of 3,4,5,6-Tetrahydrophthalic acid is 170.06 g/mol.
Where can I buy 3,4,5,6-Tetrahydrophthalic acid?
You can request a quote for 3,4,5,6-Tetrahydrophthalic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5,6-Tetrahydrophthalic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5,6-Tetrahydrophthalic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.