(3-Chloro-4-nitrophenyl)(phenyl)methanone
TL;DR: (3-Chloro-4-nitrophenyl)(phenyl)methanone (CAS 131822-44-1) is a chemical compound with molecular formula C13H8ClNO3 and molecular weight 261.01926 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3-chloro-4-nitrophenyl)-phenylmethanone
Also Known As: (3-chloro-4-nitrophenyl)(phenyl)methanone, 3-chloro-4-nitrobenzophenone, (3-chloro-4-nitro-phenyl)-phenyl-methanone, (3-chloro-4-nitrophenyl)-phenylmethanone, (3-chloro-4-nitrophenyl)phenylmethanone
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H8ClNO3 |
| Molecular Weight | 261.01926 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.01926 Da |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])Cl |
| InChIKey | DXFDGFNDWPFRSA-UHFFFAOYSA-N |
Chemical Property Profile of (3-Chloro-4-nitrophenyl)(phenyl)methanone
Property Insights of (3-Chloro-4-nitrophenyl)(phenyl)methanone
The XLogP value of 3.8 indicates that (3-Chloro-4-nitrophenyl)(phenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Chloro-4-nitrophenyl)(phenyl)methanone. Following Lipinski's Rule of Five, (3-Chloro-4-nitrophenyl)(phenyl)methanone has 0 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 (3-Chloro-4-nitrophenyl)(phenyl)methanone?
The CAS number of (3-Chloro-4-nitrophenyl)(phenyl)methanone is 131822-44-1.
What is the molecular formula of (3-Chloro-4-nitrophenyl)(phenyl)methanone?
The molecular formula of (3-Chloro-4-nitrophenyl)(phenyl)methanone is C13H8ClNO3.
What is the molecular weight of (3-Chloro-4-nitrophenyl)(phenyl)methanone?
The molecular weight of (3-Chloro-4-nitrophenyl)(phenyl)methanone is 261.01926 g/mol.
Where can I buy (3-Chloro-4-nitrophenyl)(phenyl)methanone?
You can request a quote for (3-Chloro-4-nitrophenyl)(phenyl)methanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3-Chloro-4-nitrophenyl)(phenyl)methanone?
Yes, CoreyChem provides custom synthesis services for (3-Chloro-4-nitrophenyl)(phenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.