2-Methylhexyl acrylate
TL;DR: 2-Methylhexyl acrylate (CAS 45019-22-5) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylhexyl prop-2-enoate
Also Known As: 2-Methylhexyl acrylate, 2-methylhexyl prop-2-enoate, EINECS 256-179-2, Acrylic acid 2-methylhexyl ester, Propenoic acid 2-methylhexyl ester
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 2.5419 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 140.774 |
Chemical Identifiers
| CAS Number | 45019-22-5 |
|---|---|
| SMILES | CCCCC(C)COC(=O)C=C |
Product Overview
2-Methylhexyl acrylate (CAS 45019-22-5), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: 2-methylhexyl prop-2-enoate.
Chemical Property Profile of 2-Methylhexyl acrylate
Property Insights of 2-Methylhexyl acrylate
The XLogP value of 2.5419 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylhexyl acrylate. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Methylhexyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylhexyl acrylate has 0 hydrogen bond donor(s) and 2 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-Methylhexyl acrylate?
The CAS number of 2-Methylhexyl acrylate is 45019-22-5.
What is the molecular formula of 2-Methylhexyl acrylate?
The molecular formula of 2-Methylhexyl acrylate is C10H18O2.
What is the molecular weight of 2-Methylhexyl acrylate?
The molecular weight of 2-Methylhexyl acrylate is 170.13 g/mol.
Where can I buy 2-Methylhexyl acrylate?
You can request a quote for 2-Methylhexyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylhexyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylhexyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.