![(2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid structure](/static/products/4007/400751-66-8.webp)
(2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid
TL;DR: (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid (CAS 400751-66-8) is a chemical compound with molecular formula C12H10O3 and molecular weight 202.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2-prop-2-ynoxyphenyl)prop-2-enoic acid
Also Known As: propynyloxyphenylacrylicacid, 3-[2-(2-propynyloxy)phenyl]acrylic acid, (E)-3-(2-prop-2-ynoxyphenyl)prop-2-enoic acid, (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid, 3-[2-(2-propynyloxy)phenyl]acrylicacid
| Molecular Formula | C12H10O3 |
|---|---|
| Molecular Weight | 202.06 g/mol |
| LogP | 1.7964 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 202.06299 |
| Heavy Atoms | 15 |
| Complexity | 413.12057 |
Chemical Identifiers
| CAS Number | 400751-66-8 |
|---|---|
| SMILES | C#CCOC1=CC=CC=C1/C=C/C(=O)O |
Product Overview
(2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid (CAS 400751-66-8), with molecular formula C12H10O3 and molecular weight 202.06 g/mol. IUPAC: (E)-3-(2-prop-2-ynoxyphenyl)prop-2-enoic acid.
Chemical Property Profile of (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid
Property Insights of (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid
The XLogP value of 1.7964 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid. With a topological polar surface area (TPSA) of 46.53 Ų, (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid has 1 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 (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid?
The CAS number of (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid is 400751-66-8.
What is the molecular formula of (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid?
The molecular formula of (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid is C12H10O3.
What is the molecular weight of (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid?
The molecular weight of (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid is 202.06 g/mol.
Where can I buy (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid?
You can request a quote for (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-[2-(prop-2-yn-1-yloxy)phenyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.