硫氰酸喹啉盐(1:1)
TL;DR: 硫氰酸喹啉盐(1:1) (CAS 530-65-4) is a chemical compound with molecular formula C10H8N2S and molecular weight 188.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫氰酸喹啉盐(1:1)
quinoline;thiocyanic acid
Also Known As: Quinoline rhodanide, Quinolinium thiocyanate, Quinoline sulfocyanate, quinoline thiocyanate(1:1), quinoline; thiocyanic acid
| Molecular Formula | C10H8N2S |
|---|---|
| Molecular Weight | 188.04 g/mol |
| LogP | 2.63 |
| Topological Polar Surface Area | 37.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.04082 |
| Heavy Atoms | 13 |
| Complexity | 143.0 |
Chemical Identifiers
| CAS Number | 530-65-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=N2.C(#N)S |
| InChIKey | FDLARBRFVPIGIR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫氰酸喹啉盐(1:1) (CAS 530-65-4), with molecular formula C10H8N2S and molecular weight 188.04 g/mol. IUPAC: quinoline;thiocyanic acid.
Chemical Property Profile of 硫氰酸喹啉盐(1:1)
Property Insights of 硫氰酸喹啉盐(1:1)
The XLogP value of 2.63 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫氰酸喹啉盐(1:1). With a topological polar surface area (TPSA) of 37.7 Ų, 硫氰酸喹啉盐(1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 硫氰酸喹啉盐(1:1) has 1 hydrogen bond donor(s) and 3 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 硫氰酸喹啉盐(1:1)?
The CAS number of 硫氰酸喹啉盐(1:1) is 530-65-4.
What is the molecular formula of 硫氰酸喹啉盐(1:1)?
The molecular formula of 硫氰酸喹啉盐(1:1) is C10H8N2S.
What is the molecular weight of 硫氰酸喹啉盐(1:1)?
The molecular weight of 硫氰酸喹啉盐(1:1) is 188.04 g/mol.
Where can I buy 硫氰酸喹啉盐(1:1)?
You can request a quote for 硫氰酸喹啉盐(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫氰酸喹啉盐(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 硫氰酸喹啉盐(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.