辛-4-烯二酸
TL;DR: 辛-4-烯二酸 (CAS 14277-16-8) is a chemical compound with molecular formula C8H12O4 and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
辛-4-烯二酸
oct-4-enedioic acid
Also Known As: Oct-4-enedioic acid, 4-octenedioic acid, oct-4-enedioicacid, cis-4-octenedioic acid, (E)-oct-4-enedioic acid
| Molecular Formula | C8H12O4 |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 172.07356 |
| Heavy Atoms | 12 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 14277-16-8 |
|---|---|
| SMILES | C(CC(=O)O)C=CCCC(=O)O |
| InChIKey | LQVYKEXVMZXOAH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
辛-4-烯二酸 (CAS 14277-16-8), with molecular formula C8H12O4 and molecular weight 172.07 g/mol. IUPAC: oct-4-enedioic acid.
Chemical Property Profile of 辛-4-烯二酸
Property Insights of 辛-4-烯二酸
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 辛-4-烯二酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 辛-4-烯二酸. Following Lipinski's Rule of Five, 辛-4-烯二酸 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 辛-4-烯二酸?
The CAS number of 辛-4-烯二酸 is 14277-16-8.
What is the molecular formula of 辛-4-烯二酸?
The molecular formula of 辛-4-烯二酸 is C8H12O4.
What is the molecular weight of 辛-4-烯二酸?
The molecular weight of 辛-4-烯二酸 is 172.07 g/mol.
Where can I buy 辛-4-烯二酸?
You can request a quote for 辛-4-烯二酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 辛-4-烯二酸?
Yes, KEHONG BIO provides custom synthesis services for 辛-4-烯二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.