ER4N9Luu2G
TL;DR: ER4N9Luu2G (CAS 906540-47-4) is a chemical compound with molecular formula C14H9ClO2 and molecular weight 244.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-(4-chlorophenyl)-3H-2-benzofuran-1-one
Also Known As: 3-(4-Chlorophenyl)phthalide, (S)-3beta-(4-Chlorophenyl)phthalide, J2.604.671H, (3S)-3-(4-Chlorophenyl)-1(3H)-isobenzofuranone, (3S)-3-(4-chlorophenyl)-3H-2-benzofuran-1-one
| Molecular Formula | C14H9ClO2 |
|---|---|
| Molecular Weight | 244.03 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.02911 |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 906540-47-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)[C@@H](OC2=O)C3=CC=C(C=C3)Cl |
| InChIKey | SUSCNWIPCFTMMQ-ZDUSSCGKSA-N |
Product Overview
ER4N9Luu2G (CAS 906540-47-4), with molecular formula C14H9ClO2 and molecular weight 244.03 g/mol. IUPAC: (3S)-3-(4-chlorophenyl)-3H-2-benzofuran-1-one.
Chemical Property Profile of ER4N9Luu2G
Property Insights of ER4N9Luu2G
The XLogP value of 3.3 indicates that ER4N9Luu2G is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, ER4N9Luu2G exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ER4N9Luu2G 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 ER4N9Luu2G?
The CAS number of ER4N9Luu2G is 906540-47-4.
What is the molecular formula of ER4N9Luu2G?
The molecular formula of ER4N9Luu2G is C14H9ClO2.
What is the molecular weight of ER4N9Luu2G?
The molecular weight of ER4N9Luu2G is 244.03 g/mol.
Where can I buy ER4N9Luu2G?
You can request a quote for ER4N9Luu2G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ER4N9Luu2G?
Yes, KEHONG BIO provides custom synthesis services for ER4N9Luu2G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.