2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
TL;DR: 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (CAS 356097-99-9) is a chemical compound with molecular formula C14H14ClNO3 and molecular weight 279.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Also Known As: 2-(4-chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione, 2-(4-chloro-2-hydroxyphenyl)hexahydro-1H-isoindole-1,3(2H)-dione, 2-(4-CHLORO-2-HYDROXYPHENYL)-OCTAHYDRO-1H-ISOINDOLE-1,3-DIONE
| Molecular Formula | C14H14ClNO3 |
|---|---|
| Molecular Weight | 279.07 g/mol |
| LogP | 2.7252 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.06622 |
| Heavy Atoms | 19 |
| Complexity | 533.6221 |
Chemical Identifiers
| CAS Number | 356097-99-9 |
|---|---|
| SMILES | C1CCC2C(C1)C(=O)N(C2=O)C3=C(C=C(C=C3)Cl)O |
Product Overview
2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione (CAS 356097-99-9), with molecular formula C14H14ClNO3 and molecular weight 279.07 g/mol. IUPAC: 2-(4-chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione.
Chemical Property Profile of 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
Property Insights of 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
The XLogP value of 2.7252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione. With a topological polar surface area (TPSA) of 57.61 Ų, 2-(4-Chloro-2-hydroxyphenyl)-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, 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-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 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
The CAS number of 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione is 356097-99-9.
What is the molecular formula of 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
The molecular formula of 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione is C14H14ClNO3.
What is the molecular weight of 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
The molecular weight of 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione is 279.07 g/mol.
Where can I buy 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
You can request a quote for 2-(4-Chloro-2-hydroxyphenyl)-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 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-2-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.