2,3-二氢-3-硫氰基噻吩1,1-二氧化物
TL;DR: 2,3-二氢-3-硫氰基噻吩1,1-二氧化物 (CAS 73909-05-4) is a chemical compound with molecular formula C5H5NO2S2 and molecular weight 174.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-二氢-3-硫氰基噻吩1,1-二氧化物
(1,1-dioxo-2,3-dihydrothiophen-3-yl) thiocyanate
Also Known As: 2,1-dioxide, IFLab1_003612, KST-1B8494, 1,3-dihydro-3-thienyl thiocyanate, Thiophene, 2,3-dihydro-3-thiocyanato-, 1,1-dioxide
| Molecular Formula | C5H5NO2S2 |
|---|---|
| Molecular Weight | 174.98 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.97617 |
| Heavy Atoms | 10 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 73909-05-4 |
|---|---|
| SMILES | C1C(C=CS1(=O)=O)SC#N |
| InChIKey | FPVZCZACFVXKAJ-UHFFFAOYSA-N |
Product Overview
2,3-二氢-3-硫氰基噻吩1,1-二氧化物 (CAS 73909-05-4), with molecular formula C5H5NO2S2 and molecular weight 174.98 g/mol. IUPAC: (1,1-dioxo-2,3-dihydrothiophen-3-yl) thiocyanate.
Chemical Property Profile of 2,3-二氢-3-硫氰基噻吩1,1-二氧化物
Property Insights of 2,3-二氢-3-硫氰基噻吩1,1-二氧化物
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-二氢-3-硫氰基噻吩1,1-二氧化物. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-二氢-3-硫氰基噻吩1,1-二氧化物. Following Lipinski's Rule of Five, 2,3-二氢-3-硫氰基噻吩1,1-二氧化物 has 0 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 2,3-二氢-3-硫氰基噻吩1,1-二氧化物?
The CAS number of 2,3-二氢-3-硫氰基噻吩1,1-二氧化物 is 73909-05-4.
What is the molecular formula of 2,3-二氢-3-硫氰基噻吩1,1-二氧化物?
The molecular formula of 2,3-二氢-3-硫氰基噻吩1,1-二氧化物 is C5H5NO2S2.
What is the molecular weight of 2,3-二氢-3-硫氰基噻吩1,1-二氧化物?
The molecular weight of 2,3-二氢-3-硫氰基噻吩1,1-二氧化物 is 174.98 g/mol.
Where can I buy 2,3-二氢-3-硫氰基噻吩1,1-二氧化物?
You can request a quote for 2,3-二氢-3-硫氰基噻吩1,1-二氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-二氢-3-硫氰基噻吩1,1-二氧化物?
Yes, KEHONG BIO provides custom synthesis services for 2,3-二氢-3-硫氰基噻吩1,1-二氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.