4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester
TL;DR: 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester (CAS 7500-55-2) is a chemical compound with molecular formula C10H14O4 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl cyclohex-4-ene-1,2-dicarboxylate
Also Known As: RP 1 (ester), Dimethyl 4-cyclohexene-1,2-dicarboxylate, RP 1, starbld0018115, dimethyl cyclohex-4-ene-1,2-dicarboxylate
| Molecular Formula | C10H14O4 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.0892 |
| Heavy Atoms | 14 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 7500-55-2 |
|---|---|
| SMILES | COC(=O)C1CC=CCC1C(=O)OC |
| InChIKey | DVVAGRMJGUQHLI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester (CAS 7500-55-2), with molecular formula C10H14O4 and molecular weight 198.09 g/mol. IUPAC: dimethyl cyclohex-4-ene-1,2-dicarboxylate.
Chemical Property Profile of 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester
Property Insights of 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester has 0 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 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester?
The CAS number of 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester is 7500-55-2.
What is the molecular formula of 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester?
The molecular formula of 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester is C10H14O4.
What is the molecular weight of 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester?
The molecular weight of 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester is 198.09 g/mol.
Where can I buy 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester?
You can request a quote for 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Cyclohexene-1,2-dicarboxylic acid, 1,2-dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.