Methyl 3,7,11-trimethyldodecanoate
TL;DR: Methyl 3,7,11-trimethyldodecanoate (CAS 1001-08-7) is a chemical compound with molecular formula C16H32O2 and molecular weight 256.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3,7,11-trimethyldodecanoate
Also Known As: Methyl 3,7,11-trimethyldodecanoate, Dodecanoic acid, 3,7,11-trimethyl-, methyl ester, 3,7,11-Trimethyldodecanoic acid methyl ester, 3,7,11-Trimethyl-dodecansaeure-methylester, RefChem:354587
| Molecular Formula | C16H32O2 |
|---|---|
| Molecular Weight | 256.24 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 256.24023 |
| Heavy Atoms | 18 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 1001-08-7 |
|---|---|
| SMILES | CC(C)CCCC(C)CCCC(C)CC(=O)OC |
| InChIKey | YMFMGLHUWRLVMT-UHFFFAOYSA-N |
Product Overview
Methyl 3,7,11-trimethyldodecanoate (CAS 1001-08-7), with molecular formula C16H32O2 and molecular weight 256.24 g/mol. IUPAC: methyl 3,7,11-trimethyldodecanoate.
Chemical Property Profile of Methyl 3,7,11-trimethyldodecanoate
Property Insights of Methyl 3,7,11-trimethyldodecanoate
The XLogP value of 6.7 indicates that Methyl 3,7,11-trimethyldodecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 3,7,11-trimethyldodecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3,7,11-trimethyldodecanoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 3,7,11-trimethyldodecanoate?
The CAS number of Methyl 3,7,11-trimethyldodecanoate is 1001-08-7.
What is the molecular formula of Methyl 3,7,11-trimethyldodecanoate?
The molecular formula of Methyl 3,7,11-trimethyldodecanoate is C16H32O2.
What is the molecular weight of Methyl 3,7,11-trimethyldodecanoate?
The molecular weight of Methyl 3,7,11-trimethyldodecanoate is 256.24 g/mol.
Where can I buy Methyl 3,7,11-trimethyldodecanoate?
You can request a quote for Methyl 3,7,11-trimethyldodecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3,7,11-trimethyldodecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3,7,11-trimethyldodecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.