1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one
TL;DR: 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one (CAS 13437-03-1) is a chemical compound with molecular formula C12H3Cl3N2O4 and molecular weight 343.91583 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,4-trichloro-7-nitrophenoxazin-3-one
Also Known As: 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one, 1,2,4-trichloro-7-nitrophenoxazin-3-one, KST-1B0279, 1,2,4-trichloro-7-nitro-phenoxazone, 3H-Phenoxazin-3-one, 1,2,4-trichloro-7-nitro-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H3Cl3N2O4 |
| Molecular Weight | 343.91583 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 343.91583 Da |
| Heavy Atoms | 21 |
| Complexity | 635.0 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])OC3=C(C(=O)C(=C(C3=N2)Cl)Cl)Cl |
| InChIKey | LJRBOQLUSYCVQA-UHFFFAOYSA-N |
Chemical Property Profile of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one
Property Insights of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one
The XLogP value of 3.8 indicates that 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one. Following Lipinski's Rule of Five, 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one?
The CAS number of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one is 13437-03-1.
What is the molecular formula of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one?
The molecular formula of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one is C12H3Cl3N2O4.
What is the molecular weight of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one?
The molecular weight of 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one is 343.91583 g/mol.
Where can I buy 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one?
You can request a quote for 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one?
Yes, CoreyChem provides custom synthesis services for 1,2,4-Trichloro-7-nitro-3H-phenoxazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.