3,3-Bis(4-methoxyphenyl)phthalide
TL;DR: 3,3-Bis(4-methoxyphenyl)phthalide (CAS 6994-88-3) is a chemical compound with molecular formula C22H18O4 and molecular weight 346.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(4-methoxyphenyl)-2-benzofuran-1-one
Also Known As: 3,3-Bis(4-methoxyphenyl)phthalide, Phenylphthalein-dimethylether, phenolphthalein dimethyl ether, 3,3-bis(4-methoxyphenyl)-2-benzofuran-1-one, 3, 3-Bis(4-methoxyphenyl)phthalide
| Molecular Formula | C22H18O4 |
|---|---|
| Molecular Weight | 346.12 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.1205 |
| Heavy Atoms | 26 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 6994-88-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C4=CC=C(C=C4)OC |
| InChIKey | ACLVEZCDKFXULE-UHFFFAOYSA-N |
Product Overview
3,3-Bis(4-methoxyphenyl)phthalide (CAS 6994-88-3), with molecular formula C22H18O4 and molecular weight 346.12 g/mol. IUPAC: 3,3-bis(4-methoxyphenyl)-2-benzofuran-1-one.
Chemical Property Profile of 3,3-Bis(4-methoxyphenyl)phthalide
Property Insights of 3,3-Bis(4-methoxyphenyl)phthalide
The XLogP value of 4.3 indicates that 3,3-Bis(4-methoxyphenyl)phthalide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 3,3-Bis(4-methoxyphenyl)phthalide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Bis(4-methoxyphenyl)phthalide 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 3,3-Bis(4-methoxyphenyl)phthalide?
The CAS number of 3,3-Bis(4-methoxyphenyl)phthalide is 6994-88-3.
What is the molecular formula of 3,3-Bis(4-methoxyphenyl)phthalide?
The molecular formula of 3,3-Bis(4-methoxyphenyl)phthalide is C22H18O4.
What is the molecular weight of 3,3-Bis(4-methoxyphenyl)phthalide?
The molecular weight of 3,3-Bis(4-methoxyphenyl)phthalide is 346.12 g/mol.
Where can I buy 3,3-Bis(4-methoxyphenyl)phthalide?
You can request a quote for 3,3-Bis(4-methoxyphenyl)phthalide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Bis(4-methoxyphenyl)phthalide?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Bis(4-methoxyphenyl)phthalide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.