Acrolein phenylhydrazone
TL;DR: Acrolein phenylhydrazone (CAS 5834-97-9) is a chemical compound with molecular formula C9H10N2 and molecular weight 146.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(prop-2-enylideneamino)aniline
Also Known As: Acrolein-Phenylhydrazon, Propenal phenylhydrazone, ACROLEIN PHENYLHYDRAZONE, 2-Propenal, phenylhydrazone, NCIOpen2_000443
| Molecular Formula | C9H10N2 |
|---|---|
| Molecular Weight | 146.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.0844 |
| Heavy Atoms | 11 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 5834-97-9 |
|---|---|
| SMILES | C=CC=NNC1=CC=CC=C1 |
| InChIKey | MTZCUZLIGJOYHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acrolein phenylhydrazone (CAS 5834-97-9), with molecular formula C9H10N2 and molecular weight 146.08 g/mol. IUPAC: N-(prop-2-enylideneamino)aniline.
Chemical Property Profile of Acrolein phenylhydrazone
Property Insights of Acrolein phenylhydrazone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acrolein phenylhydrazone. With a topological polar surface area (TPSA) of 24.4 Ų, Acrolein phenylhydrazone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acrolein phenylhydrazone has 1 hydrogen bond donor(s) and 2 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 Acrolein phenylhydrazone?
The CAS number of Acrolein phenylhydrazone is 5834-97-9.
What is the molecular formula of Acrolein phenylhydrazone?
The molecular formula of Acrolein phenylhydrazone is C9H10N2.
What is the molecular weight of Acrolein phenylhydrazone?
The molecular weight of Acrolein phenylhydrazone is 146.08 g/mol.
Where can I buy Acrolein phenylhydrazone?
You can request a quote for Acrolein phenylhydrazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acrolein phenylhydrazone?
Yes, KEHONG BIO provides custom synthesis services for Acrolein phenylhydrazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.