cis-2-Phenyl-octahydroisoindole-1,3-dione
TL;DR: cis-2-Phenyl-octahydroisoindole-1,3-dione (CAS 92670-99-0) is a chemical compound with molecular formula C14H15NO2 and molecular weight 229.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3aR,7aS)-2-phenyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: cis-2-Phenyl-octahydroisoindole-1,3-dione, J2.394.298D, (1S,2R)-N-Phenylcyclohexane-1,2-dicarbimide, (3aS,7aR)-2-Phenyloctahydro-2H-isoindole-1,3-dione, (3aR,7aS)-2-phenyl-octahydro-1H-isoindole-1,3-dione
| Molecular Formula | C14H15NO2 |
|---|---|
| Molecular Weight | 229.11 g/mol |
| LogP | 2.3662 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.11028 |
| Heavy Atoms | 17 |
| Complexity | 430.54984 |
Chemical Identifiers
| CAS Number | 92670-99-0 |
|---|---|
| SMILES | C1CC[C@H]2[C@@H](C1)C(=O)N(C2=O)C3=CC=CC=C3 |
Product Overview
cis-2-Phenyl-octahydroisoindole-1,3-dione (CAS 92670-99-0), with molecular formula C14H15NO2 and molecular weight 229.11 g/mol. IUPAC: (3aR,7aS)-2-phenyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of cis-2-Phenyl-octahydroisoindole-1,3-dione
Property Insights of cis-2-Phenyl-octahydroisoindole-1,3-dione
The XLogP value of 2.3662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-2-Phenyl-octahydroisoindole-1,3-dione. With a topological polar surface area (TPSA) of 37.38 Ų, cis-2-Phenyl-octahydroisoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2-Phenyl-octahydroisoindole-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 cis-2-Phenyl-octahydroisoindole-1,3-dione?
The CAS number of cis-2-Phenyl-octahydroisoindole-1,3-dione is 92670-99-0.
What is the molecular formula of cis-2-Phenyl-octahydroisoindole-1,3-dione?
The molecular formula of cis-2-Phenyl-octahydroisoindole-1,3-dione is C14H15NO2.
What is the molecular weight of cis-2-Phenyl-octahydroisoindole-1,3-dione?
The molecular weight of cis-2-Phenyl-octahydroisoindole-1,3-dione is 229.11 g/mol.
Where can I buy cis-2-Phenyl-octahydroisoindole-1,3-dione?
You can request a quote for cis-2-Phenyl-octahydroisoindole-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 cis-2-Phenyl-octahydroisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for cis-2-Phenyl-octahydroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.