2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE
TL;DR: 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE (CAS 61692-79-3) is a chemical compound with molecular formula C13H16O2 and molecular weight 204.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylethyl (Z)-2-methylbut-2-enoate
Also Known As: Phenethyl tiglate, beta-Phenethyl angelate, Phenylethyl tiglate, Benzylcarbinyl tiglate, Phenethyl 2-methylisocrotonate
| Molecular Formula | C13H16O2 |
|---|---|
| Molecular Weight | 204.12 g/mol |
| LogP | 2.7385 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 204.11504 |
| Heavy Atoms | 15 |
| Complexity | 338.81342 |
Chemical Identifiers
| CAS Number | 61692-79-3 |
|---|---|
| SMILES | C/C=C(/C)\C(=O)OCCC1=CC=CC=C1 |
Product Overview
2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE (CAS 61692-79-3), with molecular formula C13H16O2 and molecular weight 204.12 g/mol. IUPAC: 2-phenylethyl (Z)-2-methylbut-2-enoate.
Chemical Property Profile of 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE
Property Insights of 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE
The XLogP value of 2.7385 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE. With a topological polar surface area (TPSA) of 26.3 Ų, 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE 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-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE?
The CAS number of 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE is 61692-79-3.
What is the molecular formula of 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE?
The molecular formula of 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE is C13H16O2.
What is the molecular weight of 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE?
The molecular weight of 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE is 204.12 g/mol.
Where can I buy 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE?
You can request a quote for 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE?
Yes, KEHONG BIO provides custom synthesis services for 2-PHENYLETHYL trans-2,3-DIMETHYLACRYLATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.