3-(4-Morpholinyl)-1(3H)-isobenzofuranone
TL;DR: 3-(4-Morpholinyl)-1(3H)-isobenzofuranone (CAS 4195-21-5) is a chemical compound with molecular formula C12H13NO3 and molecular weight 219.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-morpholin-4-yl-3H-2-benzofuran-1-one
Also Known As: 3-morpholinoisobenzofuran-1(3H)-one, 3-Morpholinophthalide, 4-(3-phthalideyl)morpholine, SDCCGMLS-0065773.P001, 3-morpholin-4-yl-3H-2-benzofuran-1-one
| Molecular Formula | C12H13NO3 |
|---|---|
| Molecular Weight | 219.09 g/mol |
| LogP | 1.1878 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.08954 |
| Heavy Atoms | 16 |
| Complexity | 412.47983 |
Chemical Identifiers
| CAS Number | 4195-21-5 |
|---|---|
| SMILES | C1COCCN1C2C3=CC=CC=C3C(=O)O2 |
Product Overview
3-(4-Morpholinyl)-1(3H)-isobenzofuranone (CAS 4195-21-5), with molecular formula C12H13NO3 and molecular weight 219.09 g/mol. IUPAC: 3-morpholin-4-yl-3H-2-benzofuran-1-one.
Chemical Property Profile of 3-(4-Morpholinyl)-1(3H)-isobenzofuranone
Property Insights of 3-(4-Morpholinyl)-1(3H)-isobenzofuranone
The XLogP value of 1.1878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Morpholinyl)-1(3H)-isobenzofuranone. With a topological polar surface area (TPSA) of 38.77 Ų, 3-(4-Morpholinyl)-1(3H)-isobenzofuranone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Morpholinyl)-1(3H)-isobenzofuranone 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-(4-Morpholinyl)-1(3H)-isobenzofuranone?
The CAS number of 3-(4-Morpholinyl)-1(3H)-isobenzofuranone is 4195-21-5.
What is the molecular formula of 3-(4-Morpholinyl)-1(3H)-isobenzofuranone?
The molecular formula of 3-(4-Morpholinyl)-1(3H)-isobenzofuranone is C12H13NO3.
What is the molecular weight of 3-(4-Morpholinyl)-1(3H)-isobenzofuranone?
The molecular weight of 3-(4-Morpholinyl)-1(3H)-isobenzofuranone is 219.09 g/mol.
Where can I buy 3-(4-Morpholinyl)-1(3H)-isobenzofuranone?
You can request a quote for 3-(4-Morpholinyl)-1(3H)-isobenzofuranone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Morpholinyl)-1(3H)-isobenzofuranone?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Morpholinyl)-1(3H)-isobenzofuranone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.