2-Dodecenedioic acid, dimethyl ester, (E)-
TL;DR: 2-Dodecenedioic acid, dimethyl ester, (E)- (CAS 13038-20-5) is a chemical compound with molecular formula C14H24O4 and molecular weight 256.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl dodec-2-enedioate
Also Known As: dimethyl dodecenediate, dimethyl dodec-2-enedioate, trans-Traumatinsaeure-dimethylester, 2-Dodecenedioic acid, dimethyl ester, (E)-, RefChem:260186
| Molecular Formula | C14H24O4 |
|---|---|
| Molecular Weight | 256.17 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 256.16745 |
| Heavy Atoms | 18 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 13038-20-5 |
|---|---|
| SMILES | COC(=O)CCCCCCCCC=CC(=O)OC |
| InChIKey | XKZYDAGFYXSVFG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Dodecenedioic acid, dimethyl ester, (E)- (CAS 13038-20-5), with molecular formula C14H24O4 and molecular weight 256.17 g/mol. IUPAC: dimethyl dodec-2-enedioate.
Chemical Property Profile of 2-Dodecenedioic acid, dimethyl ester, (E)-
Property Insights of 2-Dodecenedioic acid, dimethyl ester, (E)-
The XLogP value of 3.7 indicates that 2-Dodecenedioic acid, dimethyl ester, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Dodecenedioic acid, dimethyl ester, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Dodecenedioic acid, dimethyl ester, (E)- 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 2-Dodecenedioic acid, dimethyl ester, (E)-?
The CAS number of 2-Dodecenedioic acid, dimethyl ester, (E)- is 13038-20-5.
What is the molecular formula of 2-Dodecenedioic acid, dimethyl ester, (E)-?
The molecular formula of 2-Dodecenedioic acid, dimethyl ester, (E)- is C14H24O4.
What is the molecular weight of 2-Dodecenedioic acid, dimethyl ester, (E)-?
The molecular weight of 2-Dodecenedioic acid, dimethyl ester, (E)- is 256.17 g/mol.
Where can I buy 2-Dodecenedioic acid, dimethyl ester, (E)-?
You can request a quote for 2-Dodecenedioic acid, dimethyl ester, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Dodecenedioic acid, dimethyl ester, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Dodecenedioic acid, dimethyl ester, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.