2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime
TL;DR: 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime (CAS 102206-45-1) is a chemical compound with molecular formula C13H9Cl2N3O2 and molecular weight 309.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-pyridin-2-ylmethylideneamino] N-(3,4-dichlorophenyl)carbamate
Also Known As: 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime, 3,4-Dichlorocarbanilic acid, ester with 2-pyridine carboxaldehyde oxime, 2-Pyridinecarbaldehyde O-(3,4-dichlorophenyl)carbamoyl oxime, [(pyridin-2-yl)methylidene]amino N-(3,4-dichlorophenyl)carbamate, RefChem:1064657
| Molecular Formula | C13H9Cl2N3O2 |
|---|---|
| Molecular Weight | 309.01 g/mol |
| LogP | 3.971 |
| Topological Polar Surface Area | 63.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.00717 |
| Heavy Atoms | 20 |
| Complexity | 632.7683 |
Chemical Identifiers
| CAS Number | 102206-45-1 |
|---|---|
| SMILES | C1=CC=NC(=C1)/C=N/OC(=O)NC2=CC(=C(C=C2)Cl)Cl |
Product Overview
2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime (CAS 102206-45-1), with molecular formula C13H9Cl2N3O2 and molecular weight 309.01 g/mol. IUPAC: [(E)-pyridin-2-ylmethylideneamino] N-(3,4-dichlorophenyl)carbamate.
Chemical Property Profile of 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime
Property Insights of 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime
The XLogP value of 3.971 indicates that 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime. Following Lipinski's Rule of Five, 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime has 1 hydrogen bond donor(s) and 4 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 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime?
The CAS number of 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime is 102206-45-1.
What is the molecular formula of 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime?
The molecular formula of 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime is C13H9Cl2N3O2.
What is the molecular weight of 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime?
The molecular weight of 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime is 309.01 g/mol.
Where can I buy 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime?
You can request a quote for 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyridinecarboxaldehyde, O-((3,4-dichlorophenyl)carbamoyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.