1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-
TL;DR: 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- (CAS 132684-22-1) is a chemical compound with molecular formula C9H8O3 and molecular weight 164.04735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-hydroxy-3-methyl-3H-2-benzofuran-1-one
Also Known As: 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-, 4-Hydroxy-3-methyl-1(3H)-isobenzofuranone, 4-hydroxy-3-methyl-3H-2-benzofuran-1-one, 4-hydroxy-3-methyl-3H-isobenzofuran-1-one
Technical Specifications
| Molecular Formula | C9H8O3 |
| Molecular Weight | 164.04735 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.04735 Da |
| Heavy Atoms | 12 |
| Complexity | 202.0 |
| SMILES | CC1C2=C(C=CC=C2O)C(=O)O1 |
| InChIKey | MTRCQNXJOTYOSE-UHFFFAOYSA-N |
Chemical Property Profile of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-
Property Insights of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-. With a topological polar surface area (TPSA) of 46.5 Ų, 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-?
The CAS number of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- is 132684-22-1.
What is the molecular formula of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-?
The molecular formula of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- is C9H8O3.
What is the molecular weight of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-?
The molecular weight of 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- is 164.04735 g/mol.
Where can I buy 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-?
You can request a quote for 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl-?
Yes, CoreyChem provides custom synthesis services for 1(3H)-Isobenzofuranone, 4-hydroxy-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.