o-Nitrophenylacetyl chloride
TL;DR: o-Nitrophenylacetyl chloride (CAS 22751-23-1) is a chemical compound with molecular formula C8H6ClNO3 and molecular weight 199.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitrophenyl)acetyl chloride
Also Known As: 2-(2-nitrophenyl)acetyl chloride, (2-nitrophenyl)acetyl chloride, o-Nitrophenylacetyl chloride, 2-Nitrobenzeneacetyl chloride, 2-nitrophenylacetyl chloride
| Molecular Formula | C8H6ClNO3 |
|---|---|
| Molecular Weight | 199.00 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.00362 |
| Heavy Atoms | 13 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 22751-23-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CC(=O)Cl)[N+](=O)[O-] |
| InChIKey | BKTDBYAOZVFUNR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
o-Nitrophenylacetyl chloride (CAS 22751-23-1), with molecular formula C8H6ClNO3 and molecular weight 199.00 g/mol. IUPAC: 2-(2-nitrophenyl)acetyl chloride.
Chemical Property Profile of o-Nitrophenylacetyl chloride
Property Insights of o-Nitrophenylacetyl chloride
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-Nitrophenylacetyl chloride. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for o-Nitrophenylacetyl chloride. Following Lipinski's Rule of Five, o-Nitrophenylacetyl chloride 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
Frequently Asked Questions
What is the CAS number of o-Nitrophenylacetyl chloride?
The CAS number of o-Nitrophenylacetyl chloride is 22751-23-1.
What is the molecular formula of o-Nitrophenylacetyl chloride?
The molecular formula of o-Nitrophenylacetyl chloride is C8H6ClNO3.
What is the molecular weight of o-Nitrophenylacetyl chloride?
The molecular weight of o-Nitrophenylacetyl chloride is 199.00 g/mol.
Where can I buy o-Nitrophenylacetyl chloride?
You can request a quote for o-Nitrophenylacetyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Nitrophenylacetyl chloride?
Yes, KEHONG BIO provides custom synthesis services for o-Nitrophenylacetyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.