2-(2-Dodecen-1-yl)butanedioic acid
TL;DR: 2-(2-Dodecen-1-yl)butanedioic acid (CAS 13877-83-3) is a chemical compound with molecular formula C16H28O4 and molecular weight 284.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-dodec-2-enylbutanedioic acid
Also Known As: Dodec-2-enylsuccinic acid, 2-dodec-2-enylbutanedioic acid, 2-(2-Dodecen-1-yl)butanedioic acid, 2-(dodec-2-en-1-yl)butanedioic acid, Butanedioic acid,2-(2-dodecen-1-yl)-
| Molecular Formula | C16H28O4 |
|---|---|
| Molecular Weight | 284.20 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 284.19876 |
| Heavy Atoms | 20 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 13877-83-3 |
|---|---|
| SMILES | CCCCCCCCCC=CCC(CC(=O)O)C(=O)O |
| InChIKey | VAHSVKWHLFZJMH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Dodecen-1-yl)butanedioic acid (CAS 13877-83-3), with molecular formula C16H28O4 and molecular weight 284.20 g/mol. IUPAC: 2-dodec-2-enylbutanedioic acid.
Chemical Property Profile of 2-(2-Dodecen-1-yl)butanedioic acid
Property Insights of 2-(2-Dodecen-1-yl)butanedioic acid
The XLogP value of 4.8 indicates that 2-(2-Dodecen-1-yl)butanedioic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Dodecen-1-yl)butanedioic acid. Following Lipinski's Rule of Five, 2-(2-Dodecen-1-yl)butanedioic 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 2-(2-Dodecen-1-yl)butanedioic acid?
The CAS number of 2-(2-Dodecen-1-yl)butanedioic acid is 13877-83-3.
What is the molecular formula of 2-(2-Dodecen-1-yl)butanedioic acid?
The molecular formula of 2-(2-Dodecen-1-yl)butanedioic acid is C16H28O4.
What is the molecular weight of 2-(2-Dodecen-1-yl)butanedioic acid?
The molecular weight of 2-(2-Dodecen-1-yl)butanedioic acid is 284.20 g/mol.
Where can I buy 2-(2-Dodecen-1-yl)butanedioic acid?
You can request a quote for 2-(2-Dodecen-1-yl)butanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Dodecen-1-yl)butanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Dodecen-1-yl)butanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.