2,6-二甲基辛-2,6-烯二酸
TL;DR: 2,6-二甲基辛-2,6-烯二酸 (CAS 6247-66-1) is a chemical compound with molecular formula C10H14O4 and molecular weight 198.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-二甲基辛-2,6-烯二酸
2,6-dimethylocta-2,6-dienedioic acid
Also Known As: Hildebrandt acid, Bms 197491, 2,6-dimethylocta-2,6-dienedioic acid, 3,7-dimethyl-2,6-octadienedioic acid, 2,6-Octadienedioicacid, 2,6-dimethyl-
| Molecular Formula | C10H14O4 |
|---|---|
| Molecular Weight | 198.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 198.0892 |
| Heavy Atoms | 14 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 6247-66-1 |
|---|---|
| SMILES | CC(=CC(=O)O)CCC=C(C)C(=O)O |
| InChIKey | IUBQEOXMIZDLSO-UHFFFAOYSA-N |
Product Overview
2,6-二甲基辛-2,6-烯二酸 (CAS 6247-66-1), with molecular formula C10H14O4 and molecular weight 198.09 g/mol. IUPAC: 2,6-dimethylocta-2,6-dienedioic acid.
Chemical Property Profile of 2,6-二甲基辛-2,6-烯二酸
Property Insights of 2,6-二甲基辛-2,6-烯二酸
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-二甲基辛-2,6-烯二酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-二甲基辛-2,6-烯二酸. Following Lipinski's Rule of Five, 2,6-二甲基辛-2,6-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 2,6-二甲基辛-2,6-烯二酸?
The CAS number of 2,6-二甲基辛-2,6-烯二酸 is 6247-66-1.
What is the molecular formula of 2,6-二甲基辛-2,6-烯二酸?
The molecular formula of 2,6-二甲基辛-2,6-烯二酸 is C10H14O4.
What is the molecular weight of 2,6-二甲基辛-2,6-烯二酸?
The molecular weight of 2,6-二甲基辛-2,6-烯二酸 is 198.09 g/mol.
Where can I buy 2,6-二甲基辛-2,6-烯二酸?
You can request a quote for 2,6-二甲基辛-2,6-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 2,6-二甲基辛-2,6-烯二酸?
Yes, KEHONG BIO provides custom synthesis services for 2,6-二甲基辛-2,6-烯二酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.