2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate
TL;DR: 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate (CAS 67827-73-0) is a chemical compound with molecular formula C33H60O6 and molecular weight 552.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate
Also Known As: Butyl acrylate, methyl acrylate, stearyl methacrylate polymer, (C22-H42-O2.C7-H12-O2.C4-H6-O2)x-, 2-Propenoic acid, 2-methyl-, octadecyl ester, polymer with butyl 2-propenoate and methyl 2-propenoate, 2-methylidenehexanoic acid; methyl prop-2-enoate; octadecyl 2-methylprop-2-enoate, 2-Propenoic acid, 2-methyl-, octadecyl ester, polymer with butyl2-propenoate and methyl 2-propenoate
| Molecular Formula | C33H60O6 |
|---|---|
| Molecular Weight | 552.44 g/mol |
| LogP | 9.53 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 25 |
| Exact Mass | 552.43896 |
| Heavy Atoms | 39 |
| Complexity | 478.0 |
Chemical Identifiers
| CAS Number | 67827-73-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)C(=C)C.CCCCC(=C)C(=O)O.COC(=O)C=C |
| InChIKey | XHSUEINTYXJKIJ-UHFFFAOYSA-N |
Product Overview
2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate (CAS 67827-73-0), with molecular formula C33H60O6 and molecular weight 552.44 g/mol. IUPAC: 2-methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate.
Chemical Property Profile of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate
Property Insights of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate
The XLogP value of 9.53 indicates that 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate. Following Lipinski's Rule of Five, 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate?
The CAS number of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate is 67827-73-0.
What is the molecular formula of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate?
The molecular formula of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate is C33H60O6.
What is the molecular weight of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate?
The molecular weight of 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate is 552.44 g/mol.
Where can I buy 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate?
You can request a quote for 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylidenehexanoic acid;methyl prop-2-enoate;octadecyl 2-methylprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.