2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime
TL;DR: 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime (CAS 102206-42-8) is a chemical compound with molecular formula C14H11N3O4 and molecular weight 285.07495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(E)-pyridin-2-ylmethylideneamino] N-(1,3-benzodioxol-5-yl)carbamate
Also Known As: 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime, 3,4-Methylenedioxy carbanilic acid, ester with picolinaldehyde oxime, 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-ylamino)carbonyl)oxime, 2-Pyridinecarbaldehyde O-(1,3-benzodioxol-5-ylcarbamoyl)oxime, [(pyridin-2-yl)methylidene]amino N-(2H-1,3-benzodioxol-5-yl)carbamate
Technical Specifications
| Molecular Formula | C14H11N3O4 |
| Molecular Weight | 285.07495 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 82.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 285.07495 Da |
| Heavy Atoms | 21 |
| Complexity | 390.0 |
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)O/N=C/C3=CC=CC=N3 |
| InChIKey | SYJZGDIQJIDGDL-LZYBPNLTSA-N |
Chemical Property Profile of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime
Property Insights of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime. Following Lipinski's Rule of Five, 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime?
The CAS number of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime is 102206-42-8.
What is the molecular formula of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime?
The molecular formula of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime is C14H11N3O4.
What is the molecular weight of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime?
The molecular weight of 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime is 285.07495 g/mol.
Where can I buy 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime?
You can request a quote for 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime?
Yes, CoreyChem provides custom synthesis services for 2-Pyridinecarboxaldehyde, O-((1,3-benzodioxol-5-yl)carbamoyl)oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.