4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione
TL;DR: 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione (CAS 6624-08-4) is a chemical compound with molecular formula C9H11NO3 and molecular weight 181.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-4,5,6,7a-tetrahydro-3aH-4,7-epoxyisoindole-1,3-dione
Also Known As: 4-methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione, 1-methyl-10-oxa-4-azatricyclo[5.2.1.0,2,6]decane-3,5-dione, 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-4-methyl-
| Molecular Formula | C9H11NO3 |
|---|---|
| Molecular Weight | 181.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.0739 |
| Heavy Atoms | 13 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 6624-08-4 |
|---|---|
| SMILES | CC12CCC(O1)C3C2C(=O)NC3=O |
| InChIKey | UREXRAXHDWSSPX-UHFFFAOYSA-N |
Product Overview
4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione (CAS 6624-08-4), with molecular formula C9H11NO3 and molecular weight 181.07 g/mol. IUPAC: 7-methyl-4,5,6,7a-tetrahydro-3aH-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione
Property Insights of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione
The XLogP value of -0.5 indicates that 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.4 Ų, 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione 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
Frequently Asked Questions
What is the CAS number of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
The CAS number of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione is 6624-08-4.
What is the molecular formula of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
The molecular formula of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione is C9H11NO3.
What is the molecular weight of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
The molecular weight of 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione is 181.07 g/mol.
Where can I buy 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
You can request a quote for 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylhexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.