2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
TL;DR: 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione (CAS 92147-33-6) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propyl-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
Also Known As: 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione, N-propyl-7-Oxabicyclo(2.2.1)heptane-2,3-dicarboximide, 2-propyl-3a,4,5,6,7,7a-hexahydro-octahydro-1H-4,7-epoxyisoin
| Molecular Formula | C11H15NO3 |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.1052 |
| Heavy Atoms | 15 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 92147-33-6 |
|---|---|
| SMILES | CCCN1C(=O)C2C3CCC(C2C1=O)O3 |
| InChIKey | ZVMZNHYKVZOANX-UHFFFAOYSA-N |
Product Overview
2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione (CAS 92147-33-6), with molecular formula C11H15NO3 and molecular weight 209.11 g/mol. IUPAC: 2-propyl-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Property Insights of 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione. With a topological polar surface area (TPSA) of 46.6 Ų, 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione has 0 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 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
The CAS number of 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione is 92147-33-6.
What is the molecular formula of 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
The molecular formula of 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione is C11H15NO3.
What is the molecular weight of 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
The molecular weight of 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione is 209.11 g/mol.
Where can I buy 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
You can request a quote for 2-propylhexahydro-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 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-propylhexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.