2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one
TL;DR: 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one (CAS 122881-58-7) is a chemical compound with molecular formula C13H14Cl2N2O2 and molecular weight 300.04324 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one
Also Known As: 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one, 2-(2,4-dichloro-5-hydroxyphenyl)octahydro-3H-indazol-3-one, 2-(2,4-dichloro-5-hydroxy-phenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one
Technical Specifications
| Molecular Formula | C13H14Cl2N2O2 |
| Molecular Weight | 300.04324 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 300.04324 Da |
| Heavy Atoms | 19 |
| Complexity | 369.0 |
| SMILES | C1CCC2C(C1)C(=O)N(N2)C3=CC(=C(C=C3Cl)Cl)O |
| InChIKey | JPHJKBXMNIUVJT-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one
Property Insights of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one
The XLogP value of 3.1 indicates that 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one?
The CAS number of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one is 122881-58-7.
What is the molecular formula of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one?
The molecular formula of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one is C13H14Cl2N2O2.
What is the molecular weight of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one?
The molecular weight of 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one is 300.04324 g/mol.
Where can I buy 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one?
You can request a quote for 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one?
Yes, CoreyChem provides custom synthesis services for 2-(2,4-Dichloro-5-hydroxyphenyl)-3a,4,5,6,7,7a-hexahydro-1H-indazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.