4-Methylphenyl 3-phenylacrylate
TL;DR: 4-Methylphenyl 3-phenylacrylate (CAS 99429-99-9) is a chemical compound with molecular formula C16H14O2 and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl) (E)-3-phenylprop-2-enoate
Also Known As: p-cresyl cinnamate, 4-methylphenyl 3-phenylacrylate, Cinnamic acid 4-methylphenyl ester, 4-methylphenyl (E)-3-phenylpropenoate, (E)-Cinnamic acid 4-methylphenyl ester
| Molecular Formula | C16H14O2 |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 3.61382 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.09938 |
| Heavy Atoms | 18 |
| Complexity | 539.06946 |
Chemical Identifiers
| CAS Number | 99429-99-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC(=O)/C=C/C2=CC=CC=C2 |
Product Overview
4-Methylphenyl 3-phenylacrylate (CAS 99429-99-9), with molecular formula C16H14O2 and molecular weight 238.10 g/mol. IUPAC: (4-methylphenyl) (E)-3-phenylprop-2-enoate.
Chemical Property Profile of 4-Methylphenyl 3-phenylacrylate
Property Insights of 4-Methylphenyl 3-phenylacrylate
The XLogP value of 3.61382 indicates that 4-Methylphenyl 3-phenylacrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Methylphenyl 3-phenylacrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylphenyl 3-phenylacrylate 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 4-Methylphenyl 3-phenylacrylate?
The CAS number of 4-Methylphenyl 3-phenylacrylate is 99429-99-9.
What is the molecular formula of 4-Methylphenyl 3-phenylacrylate?
The molecular formula of 4-Methylphenyl 3-phenylacrylate is C16H14O2.
What is the molecular weight of 4-Methylphenyl 3-phenylacrylate?
The molecular weight of 4-Methylphenyl 3-phenylacrylate is 238.10 g/mol.
Where can I buy 4-Methylphenyl 3-phenylacrylate?
You can request a quote for 4-Methylphenyl 3-phenylacrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylphenyl 3-phenylacrylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylphenyl 3-phenylacrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.