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Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate
TL;DR: Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate (CAS 18082-15-0) is a chemical compound with molecular formula C41H80O3 and molecular weight 620.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate
Also Known As: methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate, 2H-Pyran-2-dodecanoic acid, 6-(17,19-dimethylheneicosyl)tetrahydro-, methyl ester, 6-(17,19-Dimethylhenicosyl)tetrahydro-2H-pyran-2-dodecanoic acid methyl ester, Methyl 12-[6-(17,19-dimethylhenicosyl)tetrahydro-2H-pyran-2-yl]dodecanoate, Methyl 12-[6-(17,19-dimethylhenicosyl)tetrahydro-2H-pyran-2-yl]dodecanoate #
| Molecular Formula | C41H80O3 |
|---|---|
| Molecular Weight | 620.61 g/mol |
| LogP | 17.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 33 |
| Exact Mass | 620.6107 |
| Heavy Atoms | 44 |
| Complexity | 605.0 |
Chemical Identifiers
| CAS Number | 18082-15-0 |
|---|---|
| SMILES | CCC(C)CC(C)CCCCCCCCCCCCCCCCC1CCCC(O1)CCCCCCCCCCCC(=O)OC |
| InChIKey | CLUMIZPDMRSNBW-UHFFFAOYSA-N |
Product Overview
Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate (CAS 18082-15-0), with molecular formula C41H80O3 and molecular weight 620.61 g/mol. IUPAC: methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate.
Chemical Property Profile of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate
Property Insights of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate
The XLogP value of 17.2 indicates that Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate?
The CAS number of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate is 18082-15-0.
What is the molecular formula of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate?
The molecular formula of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate is C41H80O3.
What is the molecular weight of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate?
The molecular weight of Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate is 620.61 g/mol.
Where can I buy Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate?
You can request a quote for Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 12-[6-(17,19-dimethylhenicosyl)oxan-2-yl]dodecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.