4-环己烯-1,2-二甲酸二缩水甘油酯
TL;DR: 4-环己烯-1,2-二甲酸二缩水甘油酯 (CAS 21544-03-6) is a chemical compound with molecular formula C14H18O6 and molecular weight 282.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-环己烯-1,2-二甲酸二缩水甘油酯
bis(oxiran-2-ylmethyl) cyclohex-4-ene-1,2-dicarboxylate
Also Known As: Epoxy 711, bis(oxiran-2-ylmethyl) cyclohex-4-ene-1,2-dicarboxylate, Bis(2,3-epoxypropyl) cyclohex-4-ene-1,2-dicarboxylate, 4-Benzyloxy-3-methoxybenzaldehyde, Diglycidyl 4-Cyclohexene-1,2-dicarboxylate
| Molecular Formula | C14H18O6 |
|---|---|
| Molecular Weight | 282.11 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 77.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 282.11035 |
| Heavy Atoms | 20 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 21544-03-6 |
|---|---|
| SMILES | C1C=CCC(C1C(=O)OCC2CO2)C(=O)OCC3CO3 |
| InChIKey | KTPIWUHKYIJBCR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-环己烯-1,2-二甲酸二缩水甘油酯 (CAS 21544-03-6), with molecular formula C14H18O6 and molecular weight 282.11 g/mol. IUPAC: bis(oxiran-2-ylmethyl) cyclohex-4-ene-1,2-dicarboxylate.
Chemical Property Profile of 4-环己烯-1,2-二甲酸二缩水甘油酯
Property Insights of 4-环己烯-1,2-二甲酸二缩水甘油酯
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-环己烯-1,2-二甲酸二缩水甘油酯. The TPSA of 77.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-环己烯-1,2-二甲酸二缩水甘油酯. Following Lipinski's Rule of Five, 4-环己烯-1,2-二甲酸二缩水甘油酯 has 0 hydrogen bond donor(s) and 6 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-环己烯-1,2-二甲酸二缩水甘油酯?
The CAS number of 4-环己烯-1,2-二甲酸二缩水甘油酯 is 21544-03-6.
What is the molecular formula of 4-环己烯-1,2-二甲酸二缩水甘油酯?
The molecular formula of 4-环己烯-1,2-二甲酸二缩水甘油酯 is C14H18O6.
What is the molecular weight of 4-环己烯-1,2-二甲酸二缩水甘油酯?
The molecular weight of 4-环己烯-1,2-二甲酸二缩水甘油酯 is 282.11 g/mol.
Where can I buy 4-环己烯-1,2-二甲酸二缩水甘油酯?
You can request a quote for 4-环己烯-1,2-二甲酸二缩水甘油酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-环己烯-1,2-二甲酸二缩水甘油酯?
Yes, KEHONG BIO provides custom synthesis services for 4-环己烯-1,2-二甲酸二缩水甘油酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.