1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine
TL;DR: 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine (CAS 23550-76-7) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethylideneamino)aniline
Also Known As: Piperonal, phenylhydrazone, AI3-30861, N-(1,3-benzodioxol-5-ylmethylideneamino)aniline, 1,3-Benzodioxole-5-carboxaldehyde, phenylhydrazone, 5-19-04-00229 (Beilstein Handbook Reference)
| Molecular Formula | C14H12N2O2 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 42.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.08987 |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 23550-76-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C=NNC3=CC=CC=C3 |
| InChIKey | BXPJESDAKFUKSF-UHFFFAOYSA-N |
Product Overview
1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine (CAS 23550-76-7), with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethylideneamino)aniline.
Chemical Property Profile of 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine
Property Insights of 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine
The XLogP value of 3.2 indicates that 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.9 Ų, 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine 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 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine?
The CAS number of 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine is 23550-76-7.
What is the molecular formula of 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine?
The molecular formula of 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine is C14H12N2O2.
What is the molecular weight of 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine?
The molecular weight of 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine is 240.09 g/mol.
Where can I buy 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine?
You can request a quote for 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2H-1,3-Benzodioxol-5-yl)methylidene]-2-phenylhydrazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.