4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-
TL;DR: 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- (CAS 70223-91-5) is a chemical compound with molecular formula C10H13NO3 and molecular weight 195.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aS,4R,7S,7aR)-2-ethyl-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
Also Known As: 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-, RefChem:1069559
| Molecular Formula | C10H13NO3 |
|---|---|
| Molecular Weight | 195.09 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.08954 |
| Heavy Atoms | 14 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 70223-91-5 |
|---|---|
| SMILES | CCN1C(=O)[C@@H]2[C@H]3CC[C@@H]([C@@H]2C1=O)O3 |
| InChIKey | GRFVWXQJEITYKK-KVFPUHGPSA-N |
Product Overview
4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- (CAS 70223-91-5), with molecular formula C10H13NO3 and molecular weight 195.09 g/mol. IUPAC: (3aS,4R,7S,7aR)-2-ethyl-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-
Property Insights of 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-
The XLogP value of -0.2 indicates that 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.6 Ų, 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- 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 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-?
The CAS number of 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- is 70223-91-5.
What is the molecular formula of 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-?
The molecular formula of 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- is C10H13NO3.
What is the molecular weight of 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-?
The molecular weight of 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- is 195.09 g/mol.
Where can I buy 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-?
You can request a quote for 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))-?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Epoxy-1H-isoindole-1,3(2H)-dione, hexahydro-2-ethyl-, (3aR-(3a-alpha,4-beta,7-beta,7a-alpha))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.