(3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
TL;DR: (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (CAS 65716-89-4) is a chemical compound with molecular formula C12H19NO2 and molecular weight 209.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: 2-isobutylhexahydro-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C12H19NO2 |
|---|---|
| Molecular Weight | 209.14 g/mol |
| LogP | 1.8176 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.14159 |
| Heavy Atoms | 15 |
| Complexity | 261.3467 |
Chemical Identifiers
| CAS Number | 65716-89-4 |
|---|---|
| SMILES | CC(C)CN1C(=O)[C@@H]2CCCC[C@@H]2C1=O |
Product Overview
(3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (CAS 65716-89-4), with molecular formula C12H19NO2 and molecular weight 209.14 g/mol. IUPAC: (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Property Insights of (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
The XLogP value of 1.8176 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione. With a topological polar surface area (TPSA) of 37.38 Ų, (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione has 0 hydrogen bond donor(s) and 2 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 (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
The CAS number of (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione is 65716-89-4.
What is the molecular formula of (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
The molecular formula of (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione is C12H19NO2.
What is the molecular weight of (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
The molecular weight of (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione is 209.14 g/mol.
Where can I buy (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
You can request a quote for (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for (3aR,7aS)-2-(2-methylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.