1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-
TL;DR: 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- (CAS 21615-75-8) is a chemical compound with molecular formula C15H12O2 and molecular weight 224.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)-3H-2-benzofuran-1-one
Also Known As: p-Tolylphthalid, ChemDiv1_023481, 3-(4-Methylphenyl)phthalide, 3-(P-TOLYL)PHTHALIDE, 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-
| Molecular Formula | C15H12O2 |
|---|---|
| Molecular Weight | 224.08 g/mol |
| LogP | 3.25482 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.08372 |
| Heavy Atoms | 17 |
| Complexity | 569.7306 |
Chemical Identifiers
| CAS Number | 21615-75-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C3=CC=CC=C3C(=O)O2 |
Product Overview
1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- (CAS 21615-75-8), with molecular formula C15H12O2 and molecular weight 224.08 g/mol. IUPAC: 3-(4-methylphenyl)-3H-2-benzofuran-1-one.
Chemical Property Profile of 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-
Property Insights of 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-
The XLogP value of 3.25482 indicates that 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- 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 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-?
The CAS number of 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- is 21615-75-8.
What is the molecular formula of 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-?
The molecular formula of 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- is C15H12O2.
What is the molecular weight of 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-?
The molecular weight of 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- is 224.08 g/mol.
Where can I buy 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-?
You can request a quote for 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1(3H)-Isobenzofuranone, 3-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.