Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester
TL;DR: Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester (CAS 90908-77-3) is a chemical compound with molecular formula C19H16O4 and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-ethyl-1-benzofuran-3-carbonyl)phenyl] acetate
Also Known As: TimTec1_000255, BAS 01508098, [4-(2-ethyl-1-benzofuran-3-carbonyl)phenyl] acetate, Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester, BRD-K14109669-001-01-8
| Molecular Formula | C19H16O4 |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.10486 |
| Heavy Atoms | 23 |
| Complexity | 439.0 |
Chemical Identifiers
| CAS Number | 90908-77-3 |
|---|---|
| SMILES | CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC=C(C=C3)OC(=O)C |
| InChIKey | SSMXMFYKXVRQCO-UHFFFAOYSA-N |
Product Overview
Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester (CAS 90908-77-3), with molecular formula C19H16O4 and molecular weight 308.10 g/mol. IUPAC: [4-(2-ethyl-1-benzofuran-3-carbonyl)phenyl] acetate.
Chemical Property Profile of Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester
Property Insights of Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester
The XLogP value of 4.4 indicates that Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.5 Ų, Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester has 0 hydrogen bond donor(s) and 4 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 Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester?
The CAS number of Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester is 90908-77-3.
What is the molecular formula of Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester?
The molecular formula of Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester is C19H16O4.
What is the molecular weight of Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester?
The molecular weight of Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester is 308.10 g/mol.
Where can I buy Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester?
You can request a quote for Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid 4-(2-ethyl-benzofuran-3-carbonyl)-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.