![[(E)-3-phenylbut-2-enyl] acetate structure](/static/products/214/2140-67-2.png)
[(E)-3-phenylbut-2-enyl] acetate
TL;DR: [(E)-3-phenylbut-2-enyl] acetate (CAS 2140-67-2) is a chemical compound with molecular formula C12H14O2 and molecular weight 190.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-3-phenylbut-2-enyl] acetate
Also Known As: 3-phenylbut-2-en-1-yl acetate, 3-Phenyl-2-butenyl acetate, 1-acetoxy-3-phenylbut-2-ene, 2-Phenyl-4-acetoxy-2-butene, [(E)-3-phenylbut-2-enyl] acetate
| Molecular Formula | C12H14O2 |
|---|---|
| Molecular Weight | 190.10 g/mol |
| LogP | 2.653 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.09938 |
| Heavy Atoms | 14 |
| Complexity | 325.43478 |
Chemical Identifiers
| CAS Number | 2140-67-2 |
|---|---|
| SMILES | C/C(=C\COC(=O)C)/C1=CC=CC=C1 |
Product Overview
[(E)-3-phenylbut-2-enyl] acetate (CAS 2140-67-2), with molecular formula C12H14O2 and molecular weight 190.10 g/mol. IUPAC: [(E)-3-phenylbut-2-enyl] acetate.
Chemical Property Profile of [(E)-3-phenylbut-2-enyl] acetate
Property Insights of [(E)-3-phenylbut-2-enyl] acetate
The XLogP value of 2.653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-3-phenylbut-2-enyl] acetate. With a topological polar surface area (TPSA) of 26.3 Ų, [(E)-3-phenylbut-2-enyl] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(E)-3-phenylbut-2-enyl] acetate 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 [(E)-3-phenylbut-2-enyl] acetate?
The CAS number of [(E)-3-phenylbut-2-enyl] acetate is 2140-67-2.
What is the molecular formula of [(E)-3-phenylbut-2-enyl] acetate?
The molecular formula of [(E)-3-phenylbut-2-enyl] acetate is C12H14O2.
What is the molecular weight of [(E)-3-phenylbut-2-enyl] acetate?
The molecular weight of [(E)-3-phenylbut-2-enyl] acetate is 190.10 g/mol.
Where can I buy [(E)-3-phenylbut-2-enyl] acetate?
You can request a quote for [(E)-3-phenylbut-2-enyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-3-phenylbut-2-enyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [(E)-3-phenylbut-2-enyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.