Tigladoxime
TL;DR: Tigladoxime (CAS 28052-08-6) is a chemical compound with molecular formula C5H9NO and molecular weight 99.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-[(E)-2-methylbut-2-enylidene]hydroxylamine
Also Known As: Tigladoxime, 2-Butenal, 2-methyl-, oxime, (E,E)-, (NE)-N-[(E)-2-methylbut-2-enylidene]hydroxylamine, RefChem:189991
| Molecular Formula | C5H9NO |
|---|---|
| Molecular Weight | 99.07 g/mol |
| LogP | 1.4126 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 99.06841 |
| Heavy Atoms | 7 |
| Complexity | 94.25327 |
Chemical Identifiers
| CAS Number | 28052-08-6 |
|---|---|
| SMILES | C/C=C(\C)/C=N/O |
Product Overview
Tigladoxime (CAS 28052-08-6), with molecular formula C5H9NO and molecular weight 99.07 g/mol. IUPAC: (NE)-N-[(E)-2-methylbut-2-enylidene]hydroxylamine.
Chemical Property Profile of Tigladoxime
Property Insights of Tigladoxime
The XLogP value of 1.4126 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tigladoxime. With a topological polar surface area (TPSA) of 32.59 Ų, Tigladoxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tigladoxime 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 Tigladoxime?
The CAS number of Tigladoxime is 28052-08-6.
What is the molecular formula of Tigladoxime?
The molecular formula of Tigladoxime is C5H9NO.
What is the molecular weight of Tigladoxime?
The molecular weight of Tigladoxime is 99.07 g/mol.
Where can I buy Tigladoxime?
You can request a quote for Tigladoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tigladoxime?
Yes, KEHONG BIO provides custom synthesis services for Tigladoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.