4-(Chloromethyl)-3-nitrobenzamide
TL;DR: 4-(Chloromethyl)-3-nitrobenzamide (CAS 875157-03-2) is a chemical compound with molecular formula C8H7ClN2O3 and molecular weight 214.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-3-nitrobenzamide
Also Known As: 4-(chloromethyl)-3-nitrobenzamide
| Molecular Formula | C8H7ClN2O3 |
|---|---|
| Molecular Weight | 214.01 g/mol |
| LogP | 1.4325 |
| Topological Polar Surface Area | 86.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.01453 |
| Heavy Atoms | 14 |
| Complexity | 392.17282 |
Chemical Identifiers
| CAS Number | 875157-03-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])CCl |
Product Overview
4-(Chloromethyl)-3-nitrobenzamide (CAS 875157-03-2), with molecular formula C8H7ClN2O3 and molecular weight 214.01 g/mol. IUPAC: 4-(chloromethyl)-3-nitrobenzamide.
Chemical Property Profile of 4-(Chloromethyl)-3-nitrobenzamide
Property Insights of 4-(Chloromethyl)-3-nitrobenzamide
The XLogP value of 1.4325 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Chloromethyl)-3-nitrobenzamide. The TPSA of 86.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Chloromethyl)-3-nitrobenzamide. Following Lipinski's Rule of Five, 4-(Chloromethyl)-3-nitrobenzamide 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 4-(Chloromethyl)-3-nitrobenzamide?
The CAS number of 4-(Chloromethyl)-3-nitrobenzamide is 875157-03-2.
What is the molecular formula of 4-(Chloromethyl)-3-nitrobenzamide?
The molecular formula of 4-(Chloromethyl)-3-nitrobenzamide is C8H7ClN2O3.
What is the molecular weight of 4-(Chloromethyl)-3-nitrobenzamide?
The molecular weight of 4-(Chloromethyl)-3-nitrobenzamide is 214.01 g/mol.
Where can I buy 4-(Chloromethyl)-3-nitrobenzamide?
You can request a quote for 4-(Chloromethyl)-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Chloromethyl)-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(Chloromethyl)-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.