3-羟基辛-6-烯酸
TL;DR: 3-羟基辛-6-烯酸 (CAS 128940-64-7) is a chemical compound with molecular formula CC=CCCC(CC(=O)O)O and molecular weight 158.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-羟基辛-6-烯酸
3-hydroxyoct-6-enoic acid
Also Known As: 3-Hoea, 6-Octenoic acid,3-hydroxy-, 3-Hydroxy-6-octenoic acid, 3-HYDROXYOCT-6-ENOIC ACID
| Molecular Formula | CC=CCCC(CC(=O)O)O |
|---|---|
| Molecular Weight | 158.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 158.0943 |
| Heavy Atoms | 11 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 128940-64-7 |
|---|---|
| SMILES | CC=CCCC(CC(=O)O)O |
| InChIKey | UYHGBTRCKCDOGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-羟基辛-6-烯酸 (CAS 128940-64-7), with molecular formula CC=CCCC(CC(=O)O)O and molecular weight 158.09 g/mol. IUPAC: 3-hydroxyoct-6-enoic acid.
Chemical Property Profile of 3-羟基辛-6-烯酸
Property Insights of 3-羟基辛-6-烯酸
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-羟基辛-6-烯酸. With a topological polar surface area (TPSA) of 57.5 Ų, 3-羟基辛-6-烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-羟基辛-6-烯酸 has 2 hydrogen bond donor(s) and 3 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 3-羟基辛-6-烯酸?
The CAS number of 3-羟基辛-6-烯酸 is 128940-64-7.
What is the molecular formula of 3-羟基辛-6-烯酸?
The molecular formula of 3-羟基辛-6-烯酸 is CC=CCCC(CC(=O)O)O.
What is the molecular weight of 3-羟基辛-6-烯酸?
The molecular weight of 3-羟基辛-6-烯酸 is 158.09 g/mol.
Where can I buy 3-羟基辛-6-烯酸?
You can request a quote for 3-羟基辛-6-烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-羟基辛-6-烯酸?
Yes, KEHONG BIO provides custom synthesis services for 3-羟基辛-6-烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.