2-Methyl-3-phenylprop-2-en-1-yl acetate
TL;DR: 2-Methyl-3-phenylprop-2-en-1-yl acetate (CAS 72797-29-6) 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.
(2-methyl-3-phenylprop-2-enyl) acetate
Also Known As: 2-methyl-3-phenylprop-2-en-1-yl acetate, 2-Propen-1-ol, 2-methyl-3-phenyl-, acetate, 2-Propen-1-ol, 2-methyl-3-phenyl-, 1-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 | 72797-29-6 |
|---|---|
| SMILES | CC(=CC1=CC=CC=C1)COC(=O)C |
Product Overview
2-Methyl-3-phenylprop-2-en-1-yl acetate (CAS 72797-29-6), with molecular formula C12H14O2 and molecular weight 190.10 g/mol. IUPAC: (2-methyl-3-phenylprop-2-enyl) acetate.
Chemical Property Profile of 2-Methyl-3-phenylprop-2-en-1-yl acetate
Property Insights of 2-Methyl-3-phenylprop-2-en-1-yl acetate
The XLogP value of 2.653 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-phenylprop-2-en-1-yl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Methyl-3-phenylprop-2-en-1-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-phenylprop-2-en-1-yl 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 2-Methyl-3-phenylprop-2-en-1-yl acetate?
The CAS number of 2-Methyl-3-phenylprop-2-en-1-yl acetate is 72797-29-6.
What is the molecular formula of 2-Methyl-3-phenylprop-2-en-1-yl acetate?
The molecular formula of 2-Methyl-3-phenylprop-2-en-1-yl acetate is C12H14O2.
What is the molecular weight of 2-Methyl-3-phenylprop-2-en-1-yl acetate?
The molecular weight of 2-Methyl-3-phenylprop-2-en-1-yl acetate is 190.10 g/mol.
Where can I buy 2-Methyl-3-phenylprop-2-en-1-yl acetate?
You can request a quote for 2-Methyl-3-phenylprop-2-en-1-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-3-phenylprop-2-en-1-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-phenylprop-2-en-1-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.