(2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid
TL;DR: (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid (CAS 198707-57-2) is a chemical compound with molecular formula C11H10O3 and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoic acid
Also Known As: -3- propenoicacid, (e)-3-(2,3-dihydrobenzofuran-5-yl)acrylic acid, Ramelteon Impurity 75, dihydrobenzofuranylacrylicacid, (2E)-3-(2,3-Dihydrobenzofuran-5-yl)propenoic acid
| Molecular Formula | C11H10O3 |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 1.7193 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 190.06299 |
| Heavy Atoms | 14 |
| Complexity | 393.51917 |
Chemical Identifiers
| CAS Number | 198707-57-2 |
|---|---|
| SMILES | C1COC2=C1C=C(C=C2)/C=C/C(=O)O |
Product Overview
(2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid (CAS 198707-57-2), with molecular formula C11H10O3 and molecular weight 190.06 g/mol. IUPAC: (E)-3-(2,3-dihydro-1-benzofuran-5-yl)prop-2-enoic acid.
Chemical Property Profile of (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid
Property Insights of (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid
The XLogP value of 1.7193 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid. With a topological polar surface area (TPSA) of 46.53 Ų, (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic 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-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid?
The CAS number of (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid is 198707-57-2.
What is the molecular formula of (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid?
The molecular formula of (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid is C11H10O3.
What is the molecular weight of (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid?
The molecular weight of (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid is 190.06 g/mol.
Where can I buy (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid?
You can request a quote for (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic 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-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(2,3-Dihydro-5-benzofuranyl)-2-propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.