Bis(cyclohex-3-en-1-ylmethyl) hexanedioate
TL;DR: Bis(cyclohex-3-en-1-ylmethyl) hexanedioate (CAS 63905-29-3) is a chemical compound with molecular formula C20H30O4 and molecular weight 334.21442 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(cyclohex-3-en-1-ylmethyl) hexanedioate
Also Known As: Bis(cyclohex-3-enylmethyl) adipate, Bis(3-cyclohexenylmethyl) adipate, bis(cyclohex-3-en-1-ylmethyl) hexanedioate, Adipic acid, 3-cyclohexenylmethanol diester, bis-(Cyclohex-3-enylmethyl) adipate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H30O4 |
| Molecular Weight | 334.21442 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 334.21442 Da |
| Heavy Atoms | 24 |
| Complexity | 411.0 |
| SMILES | C1CC(CC=C1)COC(=O)CCCCC(=O)OCC2CCC=CC2 |
| InChIKey | PJRVYFKLOAROIV-UHFFFAOYSA-N |
Chemical Property Profile of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate
Property Insights of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate
The XLogP value of 4.1 indicates that Bis(cyclohex-3-en-1-ylmethyl) hexanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Bis(cyclohex-3-en-1-ylmethyl) hexanedioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(cyclohex-3-en-1-ylmethyl) hexanedioate 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
What is the CAS number of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate?
The CAS number of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate is 63905-29-3.
What is the molecular formula of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate?
The molecular formula of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate is C20H30O4.
What is the molecular weight of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate?
The molecular weight of Bis(cyclohex-3-en-1-ylmethyl) hexanedioate is 334.21442 g/mol.
Where can I buy Bis(cyclohex-3-en-1-ylmethyl) hexanedioate?
You can request a quote for Bis(cyclohex-3-en-1-ylmethyl) hexanedioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bis(cyclohex-3-en-1-ylmethyl) hexanedioate?
Yes, CoreyChem provides custom synthesis services for Bis(cyclohex-3-en-1-ylmethyl) hexanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.