Selenocyanic acid, 5-indolinyl ester
TL;DR: Selenocyanic acid, 5-indolinyl ester (CAS 22129-89-1) is a chemical compound with molecular formula C9H8N2Se and molecular weight 223.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydro-1H-indol-5-yl selenocyanate
Also Known As: Indolin-5-ylselenocyanate, Indolin-5-yl selenocyanate, Selenocyanic acid, 5-indolinyl ester, Selenocyanic acid indolin-5-yl ester, 2,3-Dihydro-1H-indol-5-yl selenocyanate
| Molecular Formula | C9H8N2Se |
|---|---|
| Molecular Weight | 223.99 g/mol |
| LogP | 0.46518 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.98528 |
| Heavy Atoms | 12 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 22129-89-1 |
|---|---|
| SMILES | C1CNC2=C1C=C(C=C2)[Se]C#N |
| InChIKey | PHEBOVMEQCFURX-UHFFFAOYSA-N |
Product Overview
Selenocyanic acid, 5-indolinyl ester (CAS 22129-89-1), with molecular formula C9H8N2Se and molecular weight 223.99 g/mol. IUPAC: 2,3-dihydro-1H-indol-5-yl selenocyanate.
Chemical Property Profile of Selenocyanic acid, 5-indolinyl ester
Property Insights of Selenocyanic acid, 5-indolinyl ester
The XLogP value of 0.46518 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Selenocyanic acid, 5-indolinyl ester. With a topological polar surface area (TPSA) of 35.8 Ų, Selenocyanic acid, 5-indolinyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Selenocyanic acid, 5-indolinyl ester 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 Selenocyanic acid, 5-indolinyl ester?
The CAS number of Selenocyanic acid, 5-indolinyl ester is 22129-89-1.
What is the molecular formula of Selenocyanic acid, 5-indolinyl ester?
The molecular formula of Selenocyanic acid, 5-indolinyl ester is C9H8N2Se.
What is the molecular weight of Selenocyanic acid, 5-indolinyl ester?
The molecular weight of Selenocyanic acid, 5-indolinyl ester is 223.99 g/mol.
Where can I buy Selenocyanic acid, 5-indolinyl ester?
You can request a quote for Selenocyanic acid, 5-indolinyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Selenocyanic acid, 5-indolinyl ester?
Yes, KEHONG BIO provides custom synthesis services for Selenocyanic acid, 5-indolinyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.