![4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate structure](/static/products/3067/306730-16-5.webp)
4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate
TL;DR: 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate (CAS 306730-16-5) is a chemical compound with molecular formula C29H30O3 and molecular weight 426.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl] 4-tert-butylbenzoate
Also Known As: 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate, [4-[3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl] 4-tert-butylbenzoate, 4-{3-[4-(Propan-2-yl)phenyl]prop-2-enoyl}phenyl 4-tert-butylbenzoate
| Molecular Formula | C29H30O3 |
|---|---|
| Molecular Weight | 426.22 g/mol |
| LogP | 7.2228 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.21948 |
| Heavy Atoms | 32 |
| Complexity | 1095.0636 |
Chemical Identifiers
| CAS Number | 306730-16-5 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C(C)(C)C |
Product Overview
4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate (CAS 306730-16-5), with molecular formula C29H30O3 and molecular weight 426.22 g/mol. IUPAC: [4-[3-(4-propan-2-ylphenyl)prop-2-enoyl]phenyl] 4-tert-butylbenzoate.
Chemical Property Profile of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate
Property Insights of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate
The XLogP value of 7.2228 indicates that 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate?
The CAS number of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate is 306730-16-5.
What is the molecular formula of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate?
The molecular formula of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate is C29H30O3.
What is the molecular weight of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate?
The molecular weight of 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate is 426.22 g/mol.
Where can I buy 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate?
You can request a quote for 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 4-[3-[4-(1-Methylethyl)phenyl]-1-oxo-2-propen-1-yl]phenyl 4-(1,1-dimethylethyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.