2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate
TL;DR: 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate (CAS 68541-44-6) is a chemical compound with molecular formula C33H52O8S and molecular weight 608.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methylheptyl 3-sulfanylpropanoate;2-methylidenebutanoic acid;methyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene
Also Known As: 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate, C11-H22-O2-S.x-(C8-H8.C5-H8-O2.C5-H8-O2.C4-H6-O2)x-, 6-methylheptyl 3-sulfanylpropanoate; 2-methylidenebutanoic acid; methyl 2-methylprop-2-enoate; 2-methylprop-2-enoic acid; styrene
| Molecular Formula | C33H52O8S |
|---|---|
| Molecular Weight | 608.34 g/mol |
| LogP | 7.8153 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 15 |
| Exact Mass | 608.3383 |
| Heavy Atoms | 42 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 68541-44-6 |
|---|---|
| SMILES | CCC(=C)C(=O)O.CC(C)CCCCCOC(=O)CCS.CC(=C)C(=O)O.CC(=C)C(=O)OC.C=CC1=CC=CC=C1 |
| InChIKey | CISXSAQXDUUTKL-UHFFFAOYSA-N |
Product Overview
2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate (CAS 68541-44-6), with molecular formula C33H52O8S and molecular weight 608.34 g/mol. IUPAC: 6-methylheptyl 3-sulfanylpropanoate;2-methylidenebutanoic acid;methyl 2-methylprop-2-enoate;2-methylprop-2-enoic acid;styrene.
Chemical Property Profile of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate
Property Insights of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate
The XLogP value of 7.8153 indicates that 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate. Following Lipinski's Rule of Five, 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate?
The CAS number of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate is 68541-44-6.
What is the molecular formula of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate?
The molecular formula of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate is C33H52O8S.
What is the molecular weight of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate?
The molecular weight of 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate is 608.34 g/mol.
Where can I buy 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate?
You can request a quote for 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 2-methyl-, telomer with ethenylbenzene, ethyl 2-propenoate, isooctyl 3-mercaptopropanoate and methyl 2-methyl-2-propenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.